Diff of the two buildlogs: -- --- b1/build.log 2024-10-26 13:49:16.265875213 +0000 +++ b2/build.log 2024-10-26 14:41:04.535309113 +0000 @@ -1,6 +1,6 @@ I: pbuilder: network access will be disabled during build -I: Current time: Fri Nov 28 07:33:22 -12 2025 -I: pbuilder-time-stamp: 1764358402 +I: Current time: Sun Oct 27 03:49:21 +14 2024 +I: pbuilder-time-stamp: 1729950561 I: Building the build Environment I: extracting base tarball [/var/cache/pbuilder/unstable-reproducible-base.tgz] I: copying local configuration @@ -30,53 +30,85 @@ dpkg-source: info: applying i386-fix.patch I: Not using root during the build. I: Installing the build-deps -I: user script /srv/workspace/pbuilder/6922/tmp/hooks/D02_print_environment starting +I: user script /srv/workspace/pbuilder/3784/tmp/hooks/D01_modify_environment starting +debug: Running on infom07-i386. +I: Changing host+domainname to test build reproducibility +I: Adding a custom variable just for the fun of it... +I: Changing /bin/sh to bash +'/bin/sh' -> '/bin/bash' +lrwxrwxrwx 1 root root 9 Oct 26 13:49 /bin/sh -> /bin/bash +I: Setting pbuilder2's login shell to /bin/bash +I: Setting pbuilder2's GECOS to second user,second room,second work-phone,second home-phone,second other +I: user script /srv/workspace/pbuilder/3784/tmp/hooks/D01_modify_environment finished +I: user script /srv/workspace/pbuilder/3784/tmp/hooks/D02_print_environment starting I: set - BUILDDIR='/build/reproducible-path' - BUILDUSERGECOS='first user,first room,first work-phone,first home-phone,first other' - BUILDUSERNAME='pbuilder1' - BUILD_ARCH='i386' - DEBIAN_FRONTEND='noninteractive' - DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all parallel=6 ' - DISTRIBUTION='unstable' - HOME='/root' - HOST_ARCH='i386' + BASH=/bin/sh + BASHOPTS=checkwinsize:cmdhist:complete_fullquote:extquote:force_fignore:globasciiranges:globskipdots:hostcomplete:interactive_comments:patsub_replacement:progcomp:promptvars:sourcepath + BASH_ALIASES=() + BASH_ARGC=() + BASH_ARGV=() + BASH_CMDS=() + BASH_LINENO=([0]="12" [1]="0") + BASH_LOADABLES_PATH=/usr/local/lib/bash:/usr/lib/bash:/opt/local/lib/bash:/usr/pkg/lib/bash:/opt/pkg/lib/bash:. + BASH_SOURCE=([0]="/tmp/hooks/D02_print_environment" [1]="/tmp/hooks/D02_print_environment") + BASH_VERSINFO=([0]="5" [1]="2" [2]="32" [3]="1" [4]="release" [5]="i686-pc-linux-gnu") + BASH_VERSION='5.2.32(1)-release' + BUILDDIR=/build/reproducible-path + BUILDUSERGECOS='second user,second room,second work-phone,second home-phone,second other' + BUILDUSERNAME=pbuilder2 + BUILD_ARCH=i386 + DEBIAN_FRONTEND=noninteractive + DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all parallel=5 ' + DIRSTACK=() + DISTRIBUTION=unstable + EUID=0 + FUNCNAME=([0]="Echo" [1]="main") + GROUPS=() + HOME=/root + HOSTNAME=i-capture-the-hostname + HOSTTYPE=i686 + HOST_ARCH=i386 IFS=' ' - INVOCATION_ID='a4e1e0fb18a2434b90c1de96e703cf3e' - LANG='C' - LANGUAGE='en_US:en' - LC_ALL='C' - LD_LIBRARY_PATH='/usr/lib/libeatmydata' - LD_PRELOAD='libeatmydata.so' - MAIL='/var/mail/root' - OPTIND='1' - PATH='/usr/sbin:/usr/bin:/sbin:/bin:/usr/games' - PBCURRENTCOMMANDLINEOPERATION='build' - PBUILDER_OPERATION='build' - PBUILDER_PKGDATADIR='/usr/share/pbuilder' - PBUILDER_PKGLIBDIR='/usr/lib/pbuilder' - PBUILDER_SYSCONFDIR='/etc' - PPID='6922' - PS1='# ' - PS2='> ' + INVOCATION_ID=3cf9c6dc8401413e862b83f3c7f18d87 + LANG=C + LANGUAGE=de_CH:de + LC_ALL=C + LD_LIBRARY_PATH=/usr/lib/libeatmydata + LD_PRELOAD=libeatmydata.so + MACHTYPE=i686-pc-linux-gnu + MAIL=/var/mail/root + OPTERR=1 + OPTIND=1 + OSTYPE=linux-gnu + PATH=/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path + PBCURRENTCOMMANDLINEOPERATION=build + PBUILDER_OPERATION=build + PBUILDER_PKGDATADIR=/usr/share/pbuilder + PBUILDER_PKGLIBDIR=/usr/lib/pbuilder + PBUILDER_SYSCONFDIR=/etc + PIPESTATUS=([0]="0") + POSIXLY_CORRECT=y + PPID=3784 PS4='+ ' - PWD='/' - SHELL='/bin/bash' - SHLVL='2' - SUDO_COMMAND='/usr/bin/timeout -k 18.1h 18h /usr/bin/ionice -c 3 /usr/bin/nice /usr/sbin/pbuilder --build --configfile /srv/reproducible-results/rbuild-debian/r-b-build.Rf6v9r2A/pbuilderrc_NIKw --distribution unstable --hookdir /etc/pbuilder/first-build-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/unstable-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.Rf6v9r2A/b1 --logfile b1/build.log meep_1.25.0-4.dsc' - SUDO_GID='111' - SUDO_UID='104' - SUDO_USER='jenkins' - TERM='unknown' - TZ='/usr/share/zoneinfo/Etc/GMT+12' - USER='root' - _='/usr/bin/systemd-run' + PWD=/ + SHELL=/bin/bash + SHELLOPTS=braceexpand:errexit:hashall:interactive-comments:posix + SHLVL=3 + SUDO_COMMAND='/usr/bin/timeout -k 24.1h 24h /usr/bin/ionice -c 3 /usr/bin/nice -n 11 /usr/bin/unshare --uts -- /usr/sbin/pbuilder --build --configfile /srv/reproducible-results/rbuild-debian/r-b-build.Rf6v9r2A/pbuilderrc_8GET --distribution unstable --hookdir /etc/pbuilder/rebuild-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/unstable-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.Rf6v9r2A/b2 --logfile b2/build.log meep_1.25.0-4.dsc' + SUDO_GID=111 + SUDO_UID=104 + SUDO_USER=jenkins + TERM=unknown + TZ=/usr/share/zoneinfo/Etc/GMT-14 + UID=0 + USER=root + _='I: set' I: uname -a - Linux infom08-i386 6.10.11+bpo-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.10.11-1~bpo12+1 (2024-10-03) x86_64 GNU/Linux + Linux i-capture-the-hostname 6.1.0-26-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.1.112-1 (2024-09-30) x86_64 GNU/Linux I: ls -l /bin - lrwxrwxrwx 1 root root 7 Aug 4 2024 /bin -> usr/bin -I: user script /srv/workspace/pbuilder/6922/tmp/hooks/D02_print_environment finished + lrwxrwxrwx 1 root root 7 Aug 4 21:30 /bin -> usr/bin +I: user script /srv/workspace/pbuilder/3784/tmp/hooks/D02_print_environment finished -> Attempting to satisfy build-dependencies -> Creating pbuilder-satisfydepends-dummy package Package: pbuilder-satisfydepends-dummy @@ -393,7 +425,7 @@ Get: 235 http://deb.debian.org/debian unstable/main i386 python3-setuptools all 75.2.0-1 [731 kB] Get: 236 http://deb.debian.org/debian unstable/main i386 quilt all 0.68-1 [437 kB] Get: 237 http://deb.debian.org/debian unstable/main i386 swig i386 4.2.1-1 [1499 kB] -Fetched 159 MB in 6s (27.4 MB/s) +Fetched 159 MB in 2s (65.1 MB/s) debconf: delaying package configuration, since apt-utils is not installed Selecting previously unselected package libpython3.12-minimal:i386. (Reading database ... (Reading database ... 5% (Reading database ... 10% (Reading database ... 15% (Reading database ... 20% (Reading database ... 25% (Reading database ... 30% (Reading database ... 35% (Reading database ... 40% (Reading database ... 45% (Reading database ... 50% (Reading database ... 55% (Reading database ... 60% (Reading database ... 65% (Reading database ... 70% (Reading database ... 75% (Reading database ... 80% (Reading database ... 85% (Reading database ... 90% (Reading database ... 95% (Reading database ... 100% (Reading database ... 19933 files and directories currently installed.) @@ -1168,8 +1200,8 @@ Setting up tzdata (2024b-3) ... Current default time zone: 'Etc/UTC' -Local time is now: Fri Nov 28 19:33:57 UTC 2025. -Universal Time is now: Fri Nov 28 19:33:57 UTC 2025. +Local time is now: Sat Oct 26 13:51:13 UTC 2024. +Universal Time is now: Sat Oct 26 13:51:13 UTC 2024. Run 'dpkg-reconfigure tzdata' if you wish to change it. Setting up unicode-data (15.1.0-1) ... @@ -1383,7 +1415,11 @@ Building tag database... -> Finished parsing the build-deps I: Building the package -I: Running cd /build/reproducible-path/meep-1.25.0/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-genchanges -S > ../meep_1.25.0-4_source.changes +I: user script /srv/workspace/pbuilder/3784/tmp/hooks/A99_set_merged_usr starting +Not re-configuring usrmerge for unstable +I: user script /srv/workspace/pbuilder/3784/tmp/hooks/A99_set_merged_usr finished +hostname: Name or service not known +I: Running cd /build/reproducible-path/meep-1.25.0/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-genchanges -S > ../meep_1.25.0-4_source.changes dpkg-buildpackage: info: source package meep dpkg-buildpackage: info: source version 1.25.0-4 dpkg-buildpackage: info: source distribution unstable @@ -1649,18 +1685,18 @@ config.status: executing libtool commands make[1]: Leaving directory '/build/reproducible-path/meep-1.25.0' dh_auto_build - make -j6 + make -j5 make[1]: Entering directory '/build/reproducible-path/meep-1.25.0' make all-recursive make[2]: Entering directory '/build/reproducible-path/meep-1.25.0' Making all in src make[3]: Entering directory '/build/reproducible-path/meep-1.25.0/src' make sphere_quad -(echo "/* This file was automatically generated --- DO NOT EDIT */"; echo; sed 's/LOOP_OVER/S1LOOP_OVER/g' ../src/step_generic.cpp | sed 's/step_curl/step_curl_stride1/' | sed 's/step_update_EDHB/step_update_EDHB_stride1/' | sed 's/step_beta/step_beta_stride1/') > step_generic_stride1.cpp make[4]: Entering directory '/build/reproducible-path/meep-1.25.0/src' make[4]: warning: jobserver unavailable: using -j1. Add '+' to parent make rule. i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o sphere-quad.o sphere-quad.cpp -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o sphere_quad sphere-quad.o -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath +(echo "/* This file was automatically generated --- DO NOT EDIT */"; echo; sed 's/LOOP_OVER/S1LOOP_OVER/g' ../src/step_generic.cpp | sed 's/step_curl/step_curl_stride1/' | sed 's/step_update_EDHB/step_update_EDHB_stride1/' | sed 's/step_beta/step_beta_stride1/') > step_generic_stride1.cpp +/bin/sh ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o sphere_quad sphere-quad.o -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o sphere_quad sphere-quad.o -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath make[4]: Leaving directory '/build/reproducible-path/meep-1.25.0/src' (echo "/* This file was automatically generated --- DO NOT EDIT */"; echo; ../src/sphere_quad) > sphere-quad.h @@ -1668,27 +1704,26 @@ make[4]: Entering directory '/build/reproducible-path/meep-1.25.0/src' Making all in support make[5]: Entering directory '/build/reproducible-path/meep-1.25.0/src/support' -/bin/bash ../../libtool --tag=CC --mode=compile i686-linux-gnu-gcc -DHAVE_CONFIG_H -I. -I../.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -Werror=implicit-function-declaration -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -c -o mt19937ar.lo mt19937ar.c +/bin/sh ../../libtool --tag=CC --mode=compile i686-linux-gnu-gcc -DHAVE_CONFIG_H -I. -I../.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -Werror=implicit-function-declaration -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -c -o mt19937ar.lo mt19937ar.c libtool: compile: i686-linux-gnu-gcc -DHAVE_CONFIG_H -I. -I../.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -Werror=implicit-function-declaration -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -c mt19937ar.c -fPIC -DPIC -o .libs/mt19937ar.o libtool: compile: i686-linux-gnu-gcc -DHAVE_CONFIG_H -I. -I../.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -Werror=implicit-function-declaration -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -c mt19937ar.c -fPIC -DPIC -o mt19937ar.o >/dev/null 2>&1 -/bin/bash ../../libtool --tag=CC --mode=link i686-linux-gnu-gcc -g -O2 -Werror=implicit-function-declaration -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libsupport.la mt19937ar.lo -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath +/bin/sh ../../libtool --tag=CC --mode=link i686-linux-gnu-gcc -g -O2 -Werror=implicit-function-declaration -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libsupport.la mt19937ar.lo -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-ar cr .libs/libsupport.a .libs/mt19937ar.o libtool: link: i686-linux-gnu-ranlib .libs/libsupport.a libtool: link: ( cd ".libs" && rm -f "libsupport.la" && ln -s "../libsupport.la" "libsupport.la" ) make[5]: Leaving directory '/build/reproducible-path/meep-1.25.0/src/support' make[5]: Entering directory '/build/reproducible-path/meep-1.25.0/src' -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o array_slice.lo array_slice.cpp -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o anisotropic_averaging.lo anisotropic_averaging.cpp -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o bands.lo bands.cpp -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o boundaries.lo boundaries.cpp -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o bicgstab.lo bicgstab.cpp -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o casimir.lo casimir.cpp -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c casimir.cpp -fPIC -DPIC -o .libs/casimir.o -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c bands.cpp -fPIC -DPIC -o .libs/bands.o -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c bicgstab.cpp -fPIC -DPIC -o .libs/bicgstab.o -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c anisotropic_averaging.cpp -fPIC -DPIC -o 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-I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o multilevel-atom.lo multilevel-atom.cpp libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c multilevel-atom.cpp -fPIC -DPIC -o .libs/multilevel-atom.o -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o near2far.lo near2far.cpp +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c monitor.cpp -fPIC -DPIC -o monitor.o >/dev/null 2>&1 +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o near2far.lo near2far.cpp +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o output_directory.lo output_directory.cpp +multilevel-atom.cpp: In member function 'virtual void* meep::multilevel_susceptibility::new_internal_data(meep::realnum* (*)[2], const meep::grid_volume&) const': +multilevel-atom.cpp:138:53: warning: format '%lu' expects argument of type 'long unsigned int', but argument 4 has type 'size_t' {aka 'unsigned int'} [-Wformat=] + 138 | if (d == NULL) meep::abort("%s:%i:out of memory(%lu)", __FILE__, __LINE__, sz); + | ~~^ ~~ + | | | + | long unsigned int size_t {aka unsigned int} + | %u libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c near2far.cpp -fPIC -DPIC -o .libs/near2far.o -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c integrate2.cpp -fPIC -DPIC -o integrate2.o >/dev/null 2>&1 +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c output_directory.cpp -fPIC -DPIC -o .libs/output_directory.o mympi.cpp: In function 'meep::ivec meep::max_to_all(const ivec&)': mympi.cpp:402:7: warning: variable 'in' set but not used [-Wunused-but-set-variable] 402 | int in[5], out[5]; | ^~ -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c monitor.cpp -fPIC -DPIC -o monitor.o >/dev/null 2>&1 mympi.cpp: In function 'void meep::abort(const char*, ...)': mympi.cpp:242:12: warning: ignoring return value of 'int vasprintf(char**, const char*, __gnuc_va_list)' declared with attribute 'warn_unused_result' [-Wunused-result] 242 | vasprintf(&s, fmt, ap); | ~~~~~~~~~^~~~~~~~~~~~~ +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c multilevel-atom.cpp -fPIC -DPIC -o multilevel-atom.o >/dev/null 2>&1 mympi.cpp: In function 'void meep::_do_master_printf(FILE*, meep_printf_callback_func, const char*, va_list)': mympi.cpp:686:16: warning: ignoring return value of 'int vasprintf(char**, const char*, __gnuc_va_list)' declared with attribute 'warn_unused_result' [-Wunused-result] 686 | vasprintf(&s, fmt, ap); | ~~~~~~~~~^~~~~~~~~~~~~ -multilevel-atom.cpp: In member function 'virtual void* meep::multilevel_susceptibility::new_internal_data(meep::realnum* (*)[2], const meep::grid_volume&) const': -multilevel-atom.cpp:138:53: warning: format '%lu' expects argument of type 'long unsigned int', but argument 4 has type 'size_t' {aka 'unsigned int'} [-Wformat=] - 138 | if (d == NULL) meep::abort("%s:%i:out of memory(%lu)", __FILE__, __LINE__, sz); - | ~~^ ~~ - | | | - | long unsigned int size_t {aka unsigned int} - | %u +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o random.lo random.cpp libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 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-I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c multilevel-atom.cpp -fPIC -DPIC -o multilevel-atom.o >/dev/null 2>&1 -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o random.lo random.cpp libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c random.cpp -fPIC -DPIC -o .libs/random.o output_directory.cpp: In function 'const char* meep::make_output_directory(const char*, const char*)': output_directory.cpp:115:35: warning: '-out' directive output may be truncated writing 4 bytes into a region of size between 1 and 300 [-Wformat-truncation=] @@ -1850,14 +1886,17 @@ 70 | __va_arg_pack ()); | ~~~~~~~~~~~~~~~~~ libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c output_directory.cpp -fPIC -DPIC -o output_directory.o >/dev/null 2>&1 -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o sources.lo sources.cpp +libtool: 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-Wall -W -c -o step.lo step.cpp libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c step.cpp -fPIC -DPIC -o .libs/step.o -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c near2far.cpp -fPIC -DPIC -o near2far.o >/dev/null 2>&1 +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o step_db.lo step_db.cpp step.cpp:144: warning: ignoring '#pragma omp parallel' [-Wunknown-pragmas] 144 | CHUNK_OPENMP -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c random.cpp -fPIC -DPIC -o random.o >/dev/null 2>&1 +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c step_db.cpp -fPIC -DPIC -o .libs/step_db.o +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial 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'E' : 'H', i, c, d); @@ -1924,9 +1961,6 @@ | ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ 70 | __va_arg_pack ()); | ~~~~~~~~~~~~~~~~~ -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o mpb.lo mpb.cpp -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c update_eh.cpp -fPIC -DPIC -o .libs/update_eh.o -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c mpb.cpp -fPIC -DPIC -o .libs/mpb.o structure_dump.cpp: In member function 'void meep::structure::load(const char*, bool)': structure_dump.cpp:748:44: warning: '%d' directive output may be truncated writing between 1 and 2 bytes into a region of size between 1 and 10 [-Wformat-truncation=] 748 | snprintf(dname, 20, "%c_%d_sigma_%d_%d", ft == 0 ? 'E' : 'H', i, c, d); @@ -1946,15 +1980,17 @@ | ~~~~~~~~~~~~~~~~~ libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c structure_dump.cpp -fPIC -DPIC -o structure_dump.o >/dev/null 2>&1 libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c time.cpp -fPIC -DPIC -o time.o >/dev/null 2>&1 -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. 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>/dev/null 2>&1 +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o meepgeom.lo meepgeom.cpp libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c meepgeom.cpp -fPIC -DPIC -o .libs/meepgeom.o meepgeom.cpp:2959: warning: ignoring '#pragma unroll ' [-Wunknown-pragmas] 2959 | #pragma unroll -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o GDSIIgeom.lo GDSIIgeom.cpp +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o GDSIIgeom.lo GDSIIgeom.cpp libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c GDSIIgeom.cpp -fPIC -DPIC -o .libs/GDSIIgeom.o meepgeom.cpp: In copy constructor 'meep_geom::geom_epsilon::geom_epsilon(const meep_geom::geom_epsilon&)': meepgeom.cpp:711:1: warning: base class 'class meep::material_function' should be explicitly initialized in the copy constructor [-Wextra] @@ -2095,12 +2131,14 @@ meepgeom.cpp:2832:88: warning: unused parameter 'where' [-Wunused-parameter] 2832 | double scalegrad, meep::grid_volume &gv, meep::volume &where, | ~~~~~~~~~~~~~~^~~~~ -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o step_generic_stride1.lo step_generic_stride1.cpp -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c step_generic_stride1.cpp -fPIC -DPIC -o .libs/step_generic_stride1.o meepgeom.cpp: In function 'std::complex meep_geom::cond_cmp(meep::component, const meep::vec&, double, geom_epsilon*)': meepgeom.cpp:2617:1: warning: control reaches end of non-void function [-Wreturn-type] 2617 | } | ^ +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o step_generic_stride1.lo step_generic_stride1.cpp +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c vec.cpp -fPIC -DPIC -o vec.o >/dev/null 2>&1 +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c GDSIIgeom.cpp -fPIC -DPIC -o GDSIIgeom.o >/dev/null 2>&1 +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c step_generic_stride1.cpp -fPIC -DPIC -o .libs/step_generic_stride1.o step_generic_stride1.cpp:93: warning: ignoring '#pragma omp parallel' [-Wunknown-pragmas] 93 | PS1LOOP_OVER_IVECS(gv, is, ie, i) { step_generic_stride1.cpp:93: warning: ignoring '#pragma omp simd' [-Wunknown-pragmas] @@ -2227,8 +2265,7 @@ step_generic_stride1.cpp:585: warning: ignoring '#pragma omp parallel' [-Wunknown-pragmas] 585 | PS1LOOP_OVER_IVECS(gv, is, ie, i) { f[i] = g[i]; } step_generic_stride1.cpp:585: warning: ignoring '#pragma omp simd' [-Wunknown-pragmas] -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c GDSIIgeom.cpp -fPIC -DPIC -o GDSIIgeom.o >/dev/null 2>&1 -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c vec.cpp -fPIC -DPIC -o vec.o >/dev/null 2>&1 +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c step_generic.cpp -fPIC -DPIC -o step_generic.o >/dev/null 2>&1 meepgeom.cpp: In function 'void meep_geom::material_grids_addgradient_point(double*, vector3, double, geom_epsilon*, meep::component, meep::component, std::complex, std::complex, double, meep::grid_volume&, double)': meepgeom.cpp:2824:28: warning: 'kind' may be used uninitialized [-Wmaybe-uninitialized] 2824 | add_interpolate_weights(p.x, p.y, p.z, vcur, sz.x, sz.y, sz.z, 1, scalegrad, ucur, kind, uval, @@ -2238,10 +2275,9 @@ meepgeom.cpp:2760:7: note: 'kind' was declared here 2760 | int kind; | ^~~~ -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c step_generic.cpp -fPIC -DPIC -o step_generic.o >/dev/null 2>&1 libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c meepgeom.cpp -fPIC -DPIC -o meepgeom.o >/dev/null 2>&1 libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c step_generic_stride1.cpp -fPIC -DPIC -o step_generic_stride1.o >/dev/null 2>&1 -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libmeep.la -rpath /usr/lib/i386-linux-gnu array_slice.lo anisotropic_averaging.lo bands.lo boundaries.lo bicgstab.lo casimir.lo cw_fields.lo dft.lo dft_ldos.lo energy_and_flux.lo fields.lo fields_dump.lo fix_boundary_sources.lo loop_in_chunks.lo h5fields.lo h5file.lo initialize.lo integrate.lo integrate2.lo material_data.lo monitor.lo mympi.lo multilevel-atom.lo near2far.lo output_directory.lo random.lo sources.lo step.lo step_db.lo stress.lo structure.lo structure_dump.lo susceptibility.lo time.lo update_eh.lo mpb.lo update_pols.lo vec.lo step_generic.lo meepgeom.lo GDSIIgeom.lo step_generic_stride1.lo support/libsupport.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath +/bin/sh ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libmeep.la -rpath /usr/lib/i386-linux-gnu array_slice.lo anisotropic_averaging.lo bands.lo boundaries.lo bicgstab.lo casimir.lo cw_fields.lo dft.lo dft_ldos.lo energy_and_flux.lo fields.lo fields_dump.lo fix_boundary_sources.lo loop_in_chunks.lo h5fields.lo h5file.lo initialize.lo integrate.lo integrate2.lo material_data.lo monitor.lo mympi.lo multilevel-atom.lo near2far.lo output_directory.lo random.lo sources.lo step.lo step_db.lo stress.lo structure.lo structure_dump.lo susceptibility.lo time.lo update_eh.lo mpb.lo update_pols.lo vec.lo step_generic.lo meepgeom.lo GDSIIgeom.lo step_generic_stride1.lo support/libsupport.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -fPIC -DPIC -shared -nostdlib /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/14/crtbeginS.o .libs/array_slice.o .libs/anisotropic_averaging.o .libs/bands.o .libs/boundaries.o .libs/bicgstab.o .libs/casimir.o .libs/cw_fields.o .libs/dft.o .libs/dft_ldos.o .libs/energy_and_flux.o .libs/fields.o .libs/fields_dump.o .libs/fix_boundary_sources.o .libs/loop_in_chunks.o .libs/h5fields.o .libs/h5file.o .libs/initialize.o .libs/integrate.o .libs/integrate2.o .libs/material_data.o .libs/monitor.o .libs/mympi.o .libs/multilevel-atom.o .libs/near2far.o .libs/output_directory.o .libs/random.o .libs/sources.o .libs/step.o .libs/step_db.o .libs/stress.o .libs/structure.o .libs/structure_dump.o .libs/susceptibility.o .libs/time.o .libs/update_eh.o .libs/mpb.o .libs/update_pols.o .libs/vec.o .libs/step_generic.o .libs/meepgeom.o .libs/GDSIIgeom.o .libs/step_generic_stride1.o -Wl,--whole-archive support/.libs/libsupport.a -Wl,--no-whole-archive -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/14/crtendS.o /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crtn.o -g -O2 -fstack-protector-strong -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -Wl,-soname -Wl,libmeep.so.30 -o .libs/libmeep.so.30.0.0 libtool: link: (cd ".libs" && rm -f "libmeep.so.30" && ln -s "libmeep.so.30.0.0" "libmeep.so.30") libtool: link: (cd ".libs" && rm -f "libmeep.so" && ln -s "libmeep.so.30.0.0" "libmeep.so") @@ -2288,11 +2324,14 @@ i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -DHAVE_CTL_HOOKS=1 -DHAVE_CTL_EXPORT_HOOK=1 -DCTL_SCM='"'/usr/share/libctl/base/ctl.scm'"' -DINCLUDE_SCM='"'/usr/share/libctl/base/include.scm'"' -DSPEC_SCM='"'/usr/share/meep/meep.scm'"' -DVERSION_STRING='"'"Meep 1.25.0, Copyright (C) 2005-2022 Massachusetts Institute of Technology."'"' -I/usr/include/guile/3.0 -I../src -Wno-unused-parameter -Wno-unused-variable -Wno-empty-body -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o meep-meep_wrap.o `test -f 'meep_wrap.cxx' || echo './'`meep_wrap.cxx i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -DHAVE_CTL_HOOKS=1 -DHAVE_CTL_EXPORT_HOOK=1 -DCTL_SCM='"'/usr/share/libctl/base/ctl.scm'"' -DINCLUDE_SCM='"'/usr/share/libctl/base/include.scm'"' -DSPEC_SCM='"'/usr/share/meep/meep.scm'"' -DVERSION_STRING='"'"Meep 1.25.0, Copyright (C) 2005-2022 Massachusetts Institute of Technology."'"' -I/usr/include/guile/3.0 -I../src -Wno-unused-parameter -Wno-unused-variable -Wno-empty-body -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o meep-main.o `test -f 'main.cpp' || echo './'`main.cpp i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -DHAVE_CTL_HOOKS=1 -DHAVE_CTL_EXPORT_HOOK=1 -DCTL_SCM='"'/usr/share/libctl/base/ctl.scm'"' -DINCLUDE_SCM='"'/usr/share/libctl/base/include.scm'"' -DSPEC_SCM='"'/usr/share/meep/meep.scm'"' -DVERSION_STRING='"'"Meep 1.25.0, Copyright (C) 2005-2022 Massachusetts Institute of Technology."'"' -I/usr/include/guile/3.0 -I../src -Wno-unused-parameter -Wno-unused-variable -Wno-empty-body -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o meep-geom.o `test -f 'geom.cpp' || echo './'`geom.cpp -i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -DHAVE_CTL_HOOKS=1 -DHAVE_CTL_EXPORT_HOOK=1 -DCTL_SCM='"'/usr/share/libctl/base/ctl.scm'"' -DINCLUDE_SCM='"'/usr/share/libctl/base/include.scm'"' -DSPEC_SCM='"'/usr/share/meep/meep.scm'"' -DVERSION_STRING='"'"Meep 1.25.0, Copyright (C) 2005-2022 Massachusetts Institute of Technology."'"' -I/usr/include/guile/3.0 -I../src -Wno-unused-parameter -Wno-unused-variable -Wno-empty-body -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o meep-ctl-io.o `test -f 'ctl-io.cpp' || echo './'`ctl-io.cpp geom.cpp:22:9: warning: "_GNU_SOURCE" redefined 22 | #define _GNU_SOURCE | ^~~~~~~~~~~ : note: this is the location of the previous definition +geom.cpp: In function 'vector3 normal_to_prism(ctlio::prism*, vector3)': +geom.cpp:2357:11: warning: variable 'axisp' set but not used [-Wunused-but-set-variable] + 2357 | vector3 axisp = vector3_scale(height, zhatp); + | ^~~~~ In file included from ctl-io.h:7, from main.cpp:37: main.cpp: In function 'void main_entry(void*, int, char**)': @@ -2305,6 +2344,7 @@ main.cpp:205:45: warning: cast between incompatible function types from 'scm_unused_struct* (*)(SCM, SCM, SCM, SCM, SCM, SCM)' {aka 'scm_unused_struct* (*)(scm_unused_struct*, scm_unused_struct*, scm_unused_struct*, scm_unused_struct*, scm_unused_struct*, scm_unused_struct*)'} to 'scm_unused_struct* (*)()' [-Wcast-function-type] 205 | gh_new_procedure("cadaptive-integration", (SCM(*)(void))cadaptive_integration_scm, 6, 0, 0); | ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ +i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -DHAVE_CTL_HOOKS=1 -DHAVE_CTL_EXPORT_HOOK=1 -DCTL_SCM='"'/usr/share/libctl/base/ctl.scm'"' -DINCLUDE_SCM='"'/usr/share/libctl/base/include.scm'"' -DSPEC_SCM='"'/usr/share/meep/meep.scm'"' -DVERSION_STRING='"'"Meep 1.25.0, Copyright (C) 2005-2022 Massachusetts Institute of Technology."'"' -I/usr/include/guile/3.0 -I../src -Wno-unused-parameter -Wno-unused-variable -Wno-empty-body -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o meep-ctl-io.o `test -f 'ctl-io.cpp' || echo './'`ctl-io.cpp In file included from ctl-io.h:7, from ctl-io.cpp:7: ctl-io.cpp: In function 'void ctlio::export_external_functions()': @@ -2326,28 +2366,6 @@ ctl-io.cpp:2234:42: warning: cast between incompatible function types from 'scm_unused_struct* (*)(SCM, SCM)' {aka 'scm_unused_struct* (*)(scm_unused_struct*, scm_unused_struct*)'} to 'scm_unused_struct* (*)()' [-Wcast-function-type] 2234 | gh_new_procedure("point-in-object?-aux", (SCM (*)()) point_in_objectp_aux, 2, 0, 0); | ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ -geom.cpp: In function 'vector3 normal_to_prism(ctlio::prism*, vector3)': -geom.cpp:2357:11: warning: variable 'axisp' set but not used [-Wunused-but-set-variable] - 2357 | vector3 axisp = vector3_scale(height, zhatp); - | ^~~~~ -In function 'bool get_front_object(const meep::volume&, geom_box_tree, vector3&, const ctlio::geometric_object**, vector3&, ctlio::material_type&, ctlio::material_type&)', - inlined from 'virtual void geom_epsilon::eff_chi1inv_row(meep::component, double*, const meep::volume&, double, int)' at structure.cpp:618:40: -structure.cpp:581:10: warning: 'mat1' may be used uninitialized [-Wmaybe-uninitialized] - 581 | mat2 = mat1; - | ~~~~~^~~~~~ -structure.cpp: In member function 'virtual void geom_epsilon::eff_chi1inv_row(meep::component, double*, const meep::volume&, double, int)': -structure.cpp:509:17: note: 'mat1' declared here - 509 | material_type mat1, mat2; - | ^~~~ -In function 'bool get_front_object(const meep::volume&, geom_box_tree, vector3&, const ctlio::geometric_object**, vector3&, ctlio::material_type&, ctlio::material_type&)', - inlined from 'virtual void geom_epsilon::eff_chi1inv_row(meep::component, double*, const meep::volume&, double, int)' at structure.cpp:618:40: -structure.cpp:595:15: warning: 'mat1' may be used uninitialized [-Wmaybe-uninitialized] - 595 | mat_front = mat1; - | ~~~~~~~~~~^~~~~~ -structure.cpp: In member function 'virtual void geom_epsilon::eff_chi1inv_row(meep::component, double*, const meep::volume&, double, int)': -structure.cpp:509:17: note: 'mat1' declared here - 509 | material_type mat1, mat2; - | ^~~~ meep_wrap.cxx: In function 'scm_unused_struct* _wrap_new_meep_dft_flux__SWIG_0(int, scm_unused_struct**)': meep_wrap.cxx:36013:12: warning: type qualifiers ignored on cast result type [-Wignored-qualifiers] 36013 | arg1 = (meep::component const) scm_to_int(argv[0]); @@ -2369,13 +2387,31 @@ meep_wrap.cxx:36145:12: warning: type qualifiers ignored on cast result type [-Wignored-qualifiers] 36145 | arg2 = (meep::component const) scm_to_int(argv[1]); | ^~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o meep meep-meep.o meep-structure.o meep-meep_wrap.o meep-main.o meep-geom.o meep-ctl-io.o ../src/libmeep.la -lctl -lguile-3.0 -lgc -lpthread -ldl -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath +In function 'bool get_front_object(const meep::volume&, geom_box_tree, vector3&, const ctlio::geometric_object**, vector3&, ctlio::material_type&, ctlio::material_type&)', + inlined from 'virtual void geom_epsilon::eff_chi1inv_row(meep::component, double*, const meep::volume&, double, int)' at structure.cpp:618:40: +structure.cpp:581:10: warning: 'mat1' may be used uninitialized [-Wmaybe-uninitialized] + 581 | mat2 = mat1; + | ~~~~~^~~~~~ +structure.cpp: In member function 'virtual void geom_epsilon::eff_chi1inv_row(meep::component, double*, const meep::volume&, double, int)': +structure.cpp:509:17: note: 'mat1' declared here + 509 | material_type mat1, mat2; + | ^~~~ +In function 'bool get_front_object(const meep::volume&, geom_box_tree, vector3&, const ctlio::geometric_object**, vector3&, ctlio::material_type&, ctlio::material_type&)', + inlined from 'virtual void geom_epsilon::eff_chi1inv_row(meep::component, double*, const meep::volume&, double, int)' at structure.cpp:618:40: +structure.cpp:595:15: warning: 'mat1' may be used uninitialized [-Wmaybe-uninitialized] + 595 | mat_front = mat1; + | ~~~~~~~~~~^~~~~~ +structure.cpp: In member function 'virtual void geom_epsilon::eff_chi1inv_row(meep::component, double*, const meep::volume&, double, int)': +structure.cpp:509:17: note: 'mat1' declared here + 509 | material_type mat1, mat2; + | ^~~~ +/bin/sh ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o meep meep-meep.o meep-structure.o meep-meep_wrap.o meep-main.o meep-geom.o meep-ctl-io.o ../src/libmeep.la -lctl -lguile-3.0 -lgc -lpthread -ldl -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o .libs/meep meep-meep.o meep-structure.o meep-meep_wrap.o meep-main.o meep-geom.o meep-ctl-io.o ../src/.libs/libmeep.so -lctl -lguile-3.0 -lgc -lpthread -ldl -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath make[4]: Leaving directory '/build/reproducible-path/meep-1.25.0/scheme' make[3]: Leaving directory '/build/reproducible-path/meep-1.25.0/scheme' Making all in libpympb make[3]: Entering directory '/build/reproducible-path/meep-1.25.0/libpympb' -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -Wfatal-errors -I../src -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o libpympb_la-pympb.lo `test -f 'pympb.cpp' || echo './'`pympb.cpp +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -Wfatal-errors -I../src -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o libpympb_la-pympb.lo `test -f 'pympb.cpp' || echo './'`pympb.cpp libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -Wfatal-errors -I../src -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c pympb.cpp -fPIC -DPIC -o .libs/libpympb_la-pympb.o pympb.cpp:30:1: warning: multi-line comment [-Wcomment] 30 | // #define LOOP_XYZ(md) \ @@ -2400,7 +2436,7 @@ 2012 | mpi_allreduce(sq_sum2, sq_sum, 2, mpb_real, SCALAR_MPI_TYPE, MPI_SUM, mpb_comm); | ^~~~~~~~~~~~~ libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -Wfatal-errors -I../src -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c pympb.cpp -fPIC -DPIC -o libpympb_la-pympb.o >/dev/null 2>&1 -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libpympb.la -rpath /usr/lib/i386-linux-gnu libpympb_la-pympb.lo ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath +/bin/sh ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libpympb.la -rpath /usr/lib/i386-linux-gnu libpympb_la-pympb.lo ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -fPIC -DPIC -shared -nostdlib /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/14/crtbeginS.o .libs/libpympb_la-pympb.o -Wl,-rpath -Wl,/build/reproducible-path/meep-1.25.0/src/.libs ../src/.libs/libmeep.so -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/14/crtendS.o /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crtn.o -g -O2 -fstack-protector-strong -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -Wl,-soname -Wl,libpympb.so.30 -o .libs/libpympb.so.30.0.0 libtool: link: (cd ".libs" && rm -f "libpympb.so.30" && ln -s "libpympb.so.30.0.0" "libpympb.so.30") libtool: link: (cd ".libs" && rm -f "libpympb.so" && ln -s "libpympb.so.30.0.0" "libpympb.so") @@ -2426,8 +2462,8 @@ fi make all-am make[4]: Entering directory '/build/reproducible-path/meep-1.25.0/python' -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python3.12 -I/usr/lib/python3/dist-packages/numpy/core/include -I../src -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o _meep_la-meep-python.lo `test -f 'meep-python.cxx' || echo './'`meep-python.cxx -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python3.12 -I/usr/lib/python3/dist-packages/numpy/core/include -I../src -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o _mpb_la-mpb-python.lo `test -f 'mpb-python.cxx' || echo './'`mpb-python.cxx +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python3.12 -I/usr/lib/python3/dist-packages/numpy/core/include -I../src -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o _meep_la-meep-python.lo `test -f 'meep-python.cxx' || echo './'`meep-python.cxx +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python3.12 -I/usr/lib/python3/dist-packages/numpy/core/include -I../src -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o _mpb_la-mpb-python.lo `test -f 'mpb-python.cxx' || echo './'`mpb-python.cxx libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python3.12 -I/usr/lib/python3/dist-packages/numpy/core/include -I../src -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c meep-python.cxx -fPIC -DPIC -o .libs/_meep_la-meep-python.o libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python3.12 -I/usr/lib/python3/dist-packages/numpy/core/include -I../src -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c mpb-python.cxx -fPIC -DPIC -o .libs/_mpb_la-mpb-python.o In file included from mpb-python.cxx:3362: @@ -2497,13 +2533,13 @@ meep-python.cxx:125840:53: warning: unused parameter 'self' [-Wunused-parameter] 125840 | SWIGINTERN PyObject *_wrap_master_fprintf(PyObject *self, PyObject *args) { | ~~~~~~~~~~^~~~ +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python3.12 -I/usr/lib/python3/dist-packages/numpy/core/include -I../src -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c mpb-python.cxx -fPIC -DPIC -o _mpb_la-mpb-python.o >/dev/null 2>&1 In file included from meep-python.cxx:4065: typemap_utils.cpp: At global scope: typemap_utils.cpp:115:18: warning: 'PyObject* py_volume_object()' defined but not used [-Wunused-function] 115 | static PyObject *py_volume_object() { | ^~~~~~~~~~~~~~~~ -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python3.12 -I/usr/lib/python3/dist-packages/numpy/core/include -I../src -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c mpb-python.cxx -fPIC -DPIC -o _mpb_la-mpb-python.o >/dev/null 2>&1 -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _mpb.la -rpath /usr/lib/python3.12/site-packages/meep/mpb _mpb_la-mpb-python.lo ../libpympb/libpympb.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath +/bin/sh ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _mpb.la -rpath /usr/lib/python3.12/site-packages/meep/mpb _mpb_la-mpb-python.lo ../libpympb/libpympb.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -fPIC -DPIC -shared -nostdlib /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/14/crtbeginS.o .libs/_mpb_la-mpb-python.o -Wl,-rpath -Wl,/build/reproducible-path/meep-1.25.0/libpympb/.libs ../libpympb/.libs/libpympb.so -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/14/crtendS.o /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crtn.o -g -O2 -fstack-protector-strong -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -Wl,-soname -Wl,_mpb.so.30 -o .libs/_mpb.so.30.0.0 libtool: link: (cd ".libs" && rm -f "_mpb.so.30" && ln -s "_mpb.so.30.0.0" "_mpb.so.30") libtool: link: (cd ".libs" && rm -f "_mpb.so" && ln -s "_mpb.so.30.0.0" "_mpb.so") @@ -2511,7 +2547,7 @@ libtool: link: i686-linux-gnu-ranlib .libs/_mpb.a libtool: link: ( cd ".libs" && rm -f "_mpb.la" && ln -s "../_mpb.la" "_mpb.la" ) libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python3.12 -I/usr/lib/python3/dist-packages/numpy/core/include -I../src -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c meep-python.cxx -fPIC -DPIC -o _meep_la-meep-python.o >/dev/null 2>&1 -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _meep.la -rpath /usr/lib/python3.12/site-packages/meep _meep_la-meep-python.lo ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath +/bin/sh ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _meep.la -rpath /usr/lib/python3.12/site-packages/meep _meep_la-meep-python.lo ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -fPIC -DPIC -shared -nostdlib /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/14/crtbeginS.o .libs/_meep_la-meep-python.o -Wl,-rpath -Wl,/build/reproducible-path/meep-1.25.0/src/.libs ../src/.libs/libmeep.so -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/14/crtendS.o /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crtn.o -g -O2 -fstack-protector-strong -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -Wl,-soname -Wl,_meep.so.30 -o .libs/_meep.so.30.0.0 libtool: link: (cd ".libs" && rm -f "_meep.so.30" && ln -s "_meep.so.30.0.0" "_meep.so.30") libtool: link: (cd ".libs" && rm -f "_meep.so" && ln -s "_meep.so.30.0.0" "_meep.so") @@ -2566,94 +2602,94 @@ make aniso_disp bench bragg_transmission convergence_cyl_waveguide cylindrical dump_load flux harmonics integrate known_results near2far one_dimensional physical stress_tensor symmetry three_d two_dimensional 2D_convergence h5test pml pw-source-ll ring-ll cyl-ellipsoid-ll absorber-1d-ll array-slice-ll user-defined-material dft-fields gdsII-3d bend-flux-ll array-metadata make[4]: Entering directory '/build/reproducible-path/meep-1.25.0/tests' i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -DDATADIR=\"./\" -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o aniso_disp.o aniso_disp.cpp -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o aniso_disp aniso_disp.o ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath +/bin/sh ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o aniso_disp aniso_disp.o ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o .libs/aniso_disp aniso_disp.o ../src/.libs/libmeep.so -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -DDATADIR=\"./\" -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o bench.o bench.cpp -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o bench bench.o ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath +/bin/sh ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o bench bench.o ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o .libs/bench bench.o ../src/.libs/libmeep.so -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -DDATADIR=\"./\" -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -I/usr/include/guile/3.0 -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o bragg_transmission.o bragg_transmission.cpp -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o bragg_transmission bragg_transmission.o ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath +/bin/sh ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o bragg_transmission bragg_transmission.o ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o .libs/bragg_transmission bragg_transmission.o ../src/.libs/libmeep.so -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -L/usr/lib/gcc/i686-linux-gnu/14 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-./scheme/examples/cavity-farfield.ctl -./scheme/examples/stochastic-emitter.ctl -./scheme/examples/faraday-rotation.ctl -./scheme/meep_wrap.cxx -./scheme/meep_wrap.cxx.orig -./scheme/meep-ctl-swig.hpp -./scheme/ctl-io.i -./scheme/meep_op_renames.i -./scheme/meep.scm.in -./scheme/ctl-io.h -./scheme/Makefile.in -./scheme/meep-ctl.hpp -./scheme/meep.scm -./scheme/meep.cpp -./scheme/Makefile -./scheme/meep-ctl-io.o -./scheme/Makefile.am -./scheme/materials.scm -./scheme/meep_renames.i -./scheme/ctl-io.cpp -./scheme/meep -./scheme/meep-ctl-const.hpp -./scheme/structure.cpp -./scheme/main.cpp -./scheme/.libs -./scheme/.libs/meep -./scheme/meep_wrap.patch -./scheme/meep_wrap.cxx.bak -./scheme/meep-meep.o -./scheme/meep.i -./scheme/meep-structure.o -./scheme/meep-geom.o -./scheme/meep-meep_wrap.o -./scheme/meep_swig_bug_workaround.i -./scheme/meep-enums.scm -./scheme/geom.cpp -./README.md -./version.sh -./index.md -./.flake8 -./.pre-commit-config.yaml -./debian -./debian/meep.1 -./debian/libmeep30.lintian-overrides -./debian/changelog -./debian/.debhelper -./debian/.debhelper/generated -./debian/.debhelper/generated/_source -./debian/.debhelper/generated/_source/home -./debian/.debhelper/generated/_source/home/.cache -./debian/.debhelper/generated/_source/home/.cache/guile -./debian/.debhelper/generated/_source/home/.cache/guile/ccache -./debian/.debhelper/generated/_source/home/.cache/guile/ccache/3.0-LE-4-4.6 -./debian/.debhelper/generated/_source/home/.cache/guile/ccache/3.0-LE-4-4.6/usr -./debian/.debhelper/generated/_source/home/.cache/guile/ccache/3.0-LE-4-4.6/usr/share -./debian/.debhelper/generated/_source/home/.cache/guile/ccache/3.0-LE-4-4.6/usr/share/libctl -./debian/.debhelper/generated/_source/home/.cache/guile/ccache/3.0-LE-4-4.6/usr/share/libctl/base -./debian/.debhelper/generated/_source/home/.cache/guile/ccache/3.0-LE-4-4.6/usr/share/libctl/base/include.scm.go -./debian/python3-meep.postinst -./debian/upstream -./debian/upstream/metadata -./debian/autoreconf.after -./debian/meep.docs -./debian/libmeep30.install -./debian/meep.install -./debian/python3-meep.prerm -./debian/meep.manpages -./debian/python3-meep.install -./debian/README.source -./debian/missing-sources -./debian/missing-sources/highlight.js -./debian/missing-sources/jquery-2.1.1.js -./debian/missing-sources/modernizr-2.8.3.js -./debian/control -./debian/watch -./debian/patches -./debian/patches/python-distutils.patch -./debian/patches/series -./debian/patches/i386-fix.patch -./debian/autoreconf.before -./debian/rules -./debian/docs -./debian/copyright -./debian/source -./debian/source/format -./debian/source/lintian-overrides -./debian/libmeep-dev.install -./meep-pkgconfig -./meep.pc -./.gitattributes ./.github ./.github/dependabot.yml ./.github/workflows +./.github/workflows/build-san.yml ./.github/workflows/pre-commit.yml ./.github/workflows/build-ci.yml -./.github/workflows/build-san.yml -./autogen.sh -./NEWS.md -./py-compile +./compile +./config.guess +./.clang-format ./depcomp -./ltmain.sh +./config.h +./test-driver +./py-compile ./configure -./config.sub -./config.log -./libtool +./COPYRIGHT +./config.h.in +./.travis.yml +./missing +./ltmain.sh ./codecov.yml -./TODO -./.sourcery.yaml -./config.status -./install-sh -./test-driver +./Makefile.in +./add_type_hints.xonsh +./autom4te.cache +./autom4te.cache/traces.0 +./autom4te.cache/traces.3 +./autom4te.cache/output.2 +./autom4te.cache/requests +./autom4te.cache/traces.2 +./autom4te.cache/traces.1 +./autom4te.cache/output.3 +./autom4te.cache/output.1 +./autom4te.cache/output.0 ======================================== meep 1.25.0: python/test-suite.log ======================================== @@ -4180,7 +4216,7 @@ FAIL: tests/test_adjoint_solver =============================== -Matplotlib created a temporary cache directory at /tmp/matplotlib-duv0nbjn because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-l3kmwal_ because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. Traceback (most recent call last): File "/build/reproducible-path/meep-1.25.0/python/./tests/test_adjoint_solver.py", line 4, in import meep.adjoint as mpa @@ -4201,13 +4237,13 @@ from autograd import grad, jacobian ModuleNotFoundError: No module named 'autograd' -Elapsed run time = 0.2875 s +Elapsed run time = 1.2694 s FAIL tests/test_adjoint_solver.py (exit status: 1) FAIL: tests/test_adjoint_utils ============================== -Matplotlib created a temporary cache directory at /tmp/matplotlib-8lp1ajv0 because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-l9meq91x because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. Traceback (most recent call last): File "/build/reproducible-path/meep-1.25.0/python/./tests/test_adjoint_utils.py", line 11, in import meep.adjoint as mpa @@ -4228,13 +4264,13 @@ from autograd import grad, jacobian ModuleNotFoundError: No module named 'autograd' -Elapsed run time = 0.2617 s +Elapsed run time = 0.3558 s FAIL tests/test_adjoint_utils.py (exit status: 1) FAIL: tests/test_adjoint_cyl ============================ -Matplotlib created a temporary cache directory at /tmp/matplotlib-tn82diyi because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-komy4j4j because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. Traceback (most recent call last): File "/build/reproducible-path/meep-1.25.0/python/./tests/test_adjoint_cyl.py", line 4, in import meep.adjoint as mpa @@ -4255,7 +4291,7 @@ from autograd import grad, jacobian ModuleNotFoundError: No module named 'autograd' -Elapsed run time = 0.2605 s +Elapsed run time = 0.3735 s FAIL tests/test_adjoint_cyl.py (exit status: 1) FAIL: tests/test_adjoint_jax @@ -4270,13 +4306,13 @@ FAIL: tests/test_binary_partition_utils ======================================= -Matplotlib created a temporary cache directory at /tmp/matplotlib-i9vozbml because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-dhuhpomc because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. Traceback (most recent call last): File "/build/reproducible-path/meep-1.25.0/python/./tests/test_binary_partition_utils.py", line 6, in import parameterized ModuleNotFoundError: No module named 'parameterized' -Elapsed run time = 0.0024 s +Elapsed run time = 0.0030 s FAIL tests/test_binary_partition_utils.py (exit status: 1) FAIL: tests/test_binary_grating @@ -4291,19 +4327,19 @@ FAIL: tests/test_chunk_balancer =============================== -Matplotlib created a temporary cache directory at /tmp/matplotlib-tsk1llqv because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-pm01pw4m because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. Traceback (most recent call last): File "/build/reproducible-path/meep-1.25.0/python/./tests/test_chunk_balancer.py", line 5, in import parameterized ModuleNotFoundError: No module named 'parameterized' -Elapsed run time = 0.0007 s +Elapsed run time = 0.0008 s FAIL tests/test_chunk_balancer.py (exit status: 1) FAIL: tests/test_fragment_stats =============================== -Matplotlib created a temporary cache directory at /tmp/matplotlib-0yvkaz68 because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-nwmkuo0g because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. ssss....F.......................... ====================================================================== FAIL: test_1d_with_partial_fragment (__main__.TestFragmentStats.test_1d_with_partial_fragment) @@ -4316,17 +4352,17 @@ AssertionError: 483 != 480 ---------------------------------------------------------------------- -Ran 35 tests in 0.008s +Ran 35 tests in 0.014s FAILED (failures=1, skipped=4) -Elapsed run time = 0.0103 s +Elapsed run time = 0.0163 s FAIL tests/test_fragment_stats.py (exit status: 1) FAIL: tests/test_get_epsilon_grid ================================= -Matplotlib created a temporary cache directory at /tmp/matplotlib-3o4y3b7u because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-5z74v4ts because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. Traceback (most recent call last): File "/build/reproducible-path/meep-1.25.0/python/./tests/test_get_epsilon_grid.py", line 3, in import meep.adjoint as mpa @@ -4336,19 +4372,19 @@ from autograd import grad, jacobian ModuleNotFoundError: No module named 'autograd' -Elapsed run time = 0.2847 s +Elapsed run time = 0.3892 s FAIL tests/test_get_epsilon_grid.py (exit status: 1) FAIL: tests/test_material_dispersion ==================================== -Matplotlib created a temporary cache directory at /tmp/matplotlib-dhf_5tjb because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-og7xwylr because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. ----------- Initializing structure... -time for choose_chunkdivision = 1.08849e-05 s +time for choose_chunkdivision = 1.39165e-05 s Working in 2D dimensions. Computational cell is 0.05 x 0.05 x 0 with resolution 20 -time for set_epsilon = 0.000764883 s +time for set_epsilon = 0.000764993 s ----------- F ====================================================================== @@ -4373,7 +4409,7 @@ y: array([0.41054 , 0.620241, 0.828574, 1.035074, 1.239278, 1.440721]) ---------------------------------------------------------------------- -Ran 1 test in 2.240s +Ran 1 test in 2.694s FAILED (failures=1) Meep: using complex fields. @@ -4412,13 +4448,13 @@ freqs:, 7, 2.2, 0.0, 0.0, 1.4407208712852115 freqs-im:, 7, 2.2, 0.0, 0.0, -1.0601848938221453e-13 -Elapsed run time = 2.2420 s +Elapsed run time = 2.6965 s FAIL tests/test_material_dispersion.py (exit status: 1) FAIL: tests/test_material_grid ============================== -Matplotlib created a temporary cache directory at /tmp/matplotlib-n7aoe9s8 because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-kpo0smeh because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. Traceback (most recent call last): File "/build/reproducible-path/meep-1.25.0/python/./tests/test_material_grid.py", line 4, in import meep.adjoint as mpa @@ -4439,15 +4475,15 @@ from autograd import grad, jacobian ModuleNotFoundError: No module named 'autograd' -Elapsed run time = 0.2628 s +Elapsed run time = 0.3704 s FAIL tests/test_material_grid.py (exit status: 1) FAIL: tests/test_mpb ==================== -Matplotlib created a temporary cache directory at /tmp/matplotlib-6e6tdl0a because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-m4x9vykc because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. -/tmp/meepWcFBDI/test_anisotropic_2d_gap-0 +/tmp/meephWM0hz/test_anisotropic_2d_gap-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -4490,7 +4526,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002602100372314453 +elapsed time for initialization: 0.0031599998474121094 solve_kpoint (0,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3, band 4, band 5, band 6, band 7, band 8 Solving for bands 3 to 8... @@ -4601,7 +4637,7 @@ iteration 52: trace = 0.8320200571439202 (6.43433e-11% change) Finished solving for bands 3 to 8 after 52 iterations. freqs:, 1, 0, 0, 0, 0, 0, 0, 0.318992, 0.365115, 0.370143, 0.370147, 0.401833, 0.401833 -elapsed time for k point: 0.16853976249694824 +elapsed time for k point: 0.21586894989013672 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -4696,7 +4732,7 @@ iteration 45: trace = 0.8305318838345979 (5.16658e-11% change) Finished solving for bands 1 to 8 after 45 iterations. freqs:, 2, 0.1, 0, 0, 0.1, 0.0367937, 0.049071, 0.308902, 0.358341, 0.370542, 0.38729, 0.392077, 0.402396 -elapsed time for k point: 0.24631786346435547 +elapsed time for k point: 0.3144502639770508 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 6 iterations. @@ -4789,7 +4825,7 @@ iteration 44: trace = 0.8299239457452544 (6.26464e-11% change) Finished solving for bands 1 to 8 after 44 iterations. freqs:, 3, 0.2, 0, 0, 0.2, 0.0730357, 0.0965491, 0.285819, 0.360073, 0.368932, 0.371597, 0.403894, 0.408164 -elapsed time for k point: 0.24111485481262207 +elapsed time for k point: 0.31198620796203613 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -4890,7 +4926,7 @@ iteration 48: trace = 0.8282808406674247 (4.6123e-11% change) Finished solving for bands 1 to 8 after 48 iterations. freqs:, 4, 0.3, 0, 0, 0.3, 0.107851, 0.140336, 0.25846, 0.340653, 0.367325, 0.372946, 0.405794, 0.418837 -elapsed time for k point: 0.26185154914855957 +elapsed time for k point: 0.33896422386169434 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 7 iterations. @@ -4973,7 +5009,7 @@ iteration 39: trace = 0.8195746262296734 (5.8195e-11% change) Finished solving for bands 1 to 8 after 39 iterations. freqs:, 5, 0.4, 0, 0, 0.4, 0.1388, 0.176103, 0.23164, 0.313843, 0.374076, 0.377706, 0.407374, 0.410603 -elapsed time for k point: 0.2130141258239746 +elapsed time for k point: 0.2781064510345459 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -5050,7 +5086,7 @@ iteration 36: trace = 0.8152593107299858 (8.5317e-11% change) Finished solving for bands 1 to 8 after 36 iterations. freqs:, 6, 0.5, 0, 0, 0.5, 0.154816, 0.192048, 0.216968, 0.300856, 0.374518, 0.385777, 0.401594, 0.407988 -elapsed time for k point: 0.1966240406036377 +elapsed time for k point: 0.2527601718902588 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -5131,7 +5167,7 @@ iteration 38: trace = 0.8101088212743904 (5.4284e-11% change) Finished solving for bands 1 to 8 after 38 iterations. freqs:, 7, 0.5, 0.1, 0, 0.509902, 0.15975, 0.195136, 0.218441, 0.305033, 0.358789, 0.391555, 0.402172, 0.402445 -elapsed time for k point: 0.20725226402282715 +elapsed time for k point: 0.2675347328186035 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -5210,7 +5246,7 @@ iteration 37: trace = 0.8027830712683001 (5.80985e-11% change) Finished solving for bands 1 to 8 after 37 iterations. freqs:, 8, 0.5, 0.2, 0, 0.538516, 0.173344, 0.203625, 0.222584, 0.316302, 0.340088, 0.36862, 0.387671, 0.424089 -elapsed time for k point: 0.20217394828796387 +elapsed time for k point: 0.26463961601257324 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -5291,7 +5327,7 @@ iteration 38: trace = 0.8027156837865849 (5.41477e-11% change) Finished solving for bands 1 to 8 after 38 iterations. freqs:, 9, 0.5, 0.3, 0, 0.583095, 0.192437, 0.215224, 0.228468, 0.323728, 0.33113, 0.341965, 0.37019, 0.4458 -elapsed time for k point: 0.20708417892456055 +elapsed time for k point: 0.2442796230316162 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -5380,7 +5416,7 @@ iteration 42: trace = 0.8111283942460427 (9.4484e-11% change) Finished solving for bands 1 to 8 after 42 iterations. freqs:, 10, 0.5, 0.4, 0, 0.640312, 0.21184, 0.226, 0.234179, 0.311757, 0.318108, 0.344193, 0.3555, 0.465942 -elapsed time for k point: 0.23080658912658691 +elapsed time for k point: 0.22691559791564941 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -5492,7 +5528,7 @@ iteration 53: trace = 0.8190722270474012 (9.58584e-11% change) Finished solving for bands 1 to 8 after 53 iterations. freqs:, 11, 0.5, 0.5, 0, 0.707107, 0.221357, 0.230619, 0.236708, 0.307149, 0.30715, 0.349538, 0.349539, 0.477307 -elapsed time for k point: 0.28806591033935547 +elapsed time for k point: 0.3331930637359619 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -5586,7 +5622,7 @@ iteration 44: trace = 0.8090111116370089 (7.55463e-11% change) Finished solving for bands 1 to 8 after 44 iterations. freqs:, 12, 0.4, 0.4, 0, 0.565685, 0.19918, 0.2202, 0.239097, 0.309959, 0.330944, 0.347653, 0.354078, 0.460272 -elapsed time for k point: 0.23933172225952148 +elapsed time for k point: 0.3137030601501465 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -5659,7 +5695,7 @@ iteration 34: trace = 0.810101466164631 (5.20643e-11% change) Finished solving for bands 1 to 8 after 34 iterations. freqs:, 13, 0.3, 0.3, 0, 0.424264, 0.153826, 0.186625, 0.253882, 0.318156, 0.351842, 0.366269, 0.371004, 0.436281 -elapsed time for k point: 0.186478853225708 +elapsed time for k point: 0.2453022003173828 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 6 iterations. @@ -5746,7 +5782,7 @@ iteration 41: trace = 0.8249014819373072 (9.03358e-11% change) Finished solving for bands 1 to 8 after 41 iterations. freqs:, 14, 0.2, 0.2, 0, 0.282843, 0.103673, 0.133382, 0.276682, 0.331086, 0.368234, 0.382194, 0.398022, 0.412434 -elapsed time for k point: 0.22360730171203613 +elapsed time for k point: 0.2887294292449951 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 6 iterations. @@ -5827,7 +5863,7 @@ iteration 38: trace = 0.8293598597555045 (7.00917e-11% change) Finished solving for bands 1 to 8 after 38 iterations. freqs:, 15, 0.1, 0.1, 0, 0.141421, 0.0520822, 0.0690311, 0.302853, 0.347811, 0.385316, 0.389474, 0.390006, 0.396139 -elapsed time for k point: 0.2077939510345459 +elapsed time for k point: 0.2667727470397949 solve_kpoint (0,0,0): Solving for bands 3 to 8... linmin: converged after 4 iterations. @@ -5912,7 +5948,7 @@ iteration 40: trace = 0.8320200571443133 (8.05426e-11% change) Finished solving for bands 3 to 8 after 40 iterations. freqs:, 16, 0, 0, 0, 0, 0, 0, 0.318992, 0.365115, 0.370143, 0.370147, 0.401833, 0.401833 -..elapsed time for k point: 0.12850117683410645 +..elapsed time for k point: 0.16660618782043457 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.22135702280024677 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.23061915826414625 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.21696776954474636 at Vector3<0.5, 0.0, 0.0> to 0.3189924765685542 at Vector3<0.0, 0.0, 0.0> @@ -5921,15 +5957,15 @@ Band 6 range: 0.3419647255076196 at Vector3<0.5, 0.30000000000000004, 0.0> to 0.39155468442595526 at Vector3<0.5, 0.1, 0.0> Band 7 range: 0.349538537661238 at Vector3<0.5, 0.5, 0.0> to 0.4073736001230443 at Vector3<0.4, 0.0, 0.0> Band 8 range: 0.3961388233101108 at Vector3<0.09999999999999998, 0.09999999999999998, 0.0> to 0.4773065722591594 at Vector3<0.5, 0.5, 0.0> -total elapsed time for run: 3.452206611633301 +total elapsed time for run: 4.334112882614136 done -/tmp/meepWcFBDI/test_anisotropic_2d_gap-0: 3.45s +/tmp/meephWM0hz/test_anisotropic_2d_gap-0: 4.34s -/tmp/meepWcFBDI/test_attribute_accessors-0 +/tmp/meephWM0hz/test_attribute_accessors-0 ======================== -/tmp/meepWcFBDI/test_attribute_accessors-0: 0.00s +/tmp/meephWM0hz/test_attribute_accessors-0: 0.00s -/tmp/meepWcFBDI/test_bragg-0 +/tmp/meephWM0hz/test_bragg-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -5957,7 +5993,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.0, 0.0> -elapsed time for initialization: 0.00017786026000976562 +elapsed time for initialization: 0.0003676414489746094 solve_kpoint (0.5,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8 Solving for bands 1 to 8... @@ -5990,14 +6026,14 @@ iteration 13: trace = 18.62908769488902 (1.21099e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 1, 0.5, 0, 0, 0.5, 0.222451, 0.443471, 0.892368, 1.10456, 1.56579, 1.75949, 2.24248, 2.40631 -elapsed time for k point: 0.0033719539642333984 -total elapsed time for run: 0.0035903453826904297 +elapsed time for k point: 0.004382133483886719 +total elapsed time for run: 0.004830121994018555 done Fixing h-field (band 8) phase by 0.909537 + -0.415623i; max ampl. = 1.96664 -.Outputting fields to /tmp/meepWcFBDI/test_bragg-0-h.k01.b08.y.tm.h5... -/tmp/meepWcFBDI/test_bragg-0: 0.01s +.Outputting fields to /tmp/meephWM0hz/test_bragg-0-h.k01.b08.y.tm.h5... +/tmp/meephWM0hz/test_bragg-0: 3.94s -/tmp/meepWcFBDI/test_bragg_sine-0 +/tmp/meephWM0hz/test_bragg_sine-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -6033,7 +6069,7 @@ Vector3<0.4, 0.0, 0.0> Vector3<0.45, 0.0, 0.0> Vector3<0.5, 0.0, 0.0> -elapsed time for initialization: 0.002893686294555664 +elapsed time for initialization: 0.003875732421875 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8 Solving for bands 2 to 8... @@ -6047,294 +6083,287 @@ linmin: converged after 7 iterations. iteration 4: trace = 11.08896486916441 (0.79001% change) linmin: converged after 7 iterations. + switching to approximate line minimization (decrease time by 50.2203%) iteration 5: trace = 11.08297661618287 (0.0540165% change) - linmin: converged after 5 iterations. - iteration 6: trace = 11.08249596583017 (0.00433693% change) - linmin: converged after 8 iterations. - iteration 7: trace = 11.08219937893421 (0.00267621% change) - large trace change predicted (0.0167808%) - linmin: converged after 6 iterations. - iteration 8: trace = 11.08038976857812 (0.0163303% change) - large trace change predicted (0.0812499%) - linmin: converged after 9 iterations. - iteration 9: trace = 11.07305310957727 (0.0662349% change) - linmin: converged after 8 iterations. - iteration 10: trace = 11.07180721879512 (0.0112522% change) - linmin: converged after 5 iterations. - iteration 11: trace = 11.07168889845674 (0.00106867% change) - linmin: converged after 5 iterations. - iteration 12: trace = 11.07167967251344 (8.33292e-05% change) - linmin: converged after 4 iterations. - iteration 13: trace = 11.07167907314435 (5.41353e-06% change) - linmin: converged after 4 iterations. - iteration 14: trace = 11.07167888539665 (1.69575e-06% change) - large trace change predicted (8.07061e-06%) - linmin: converged after 6 iterations. - iteration 15: trace = 11.07167799184629 (8.0706e-06% change) - large trace change predicted (2.53317e-05%) - linmin: converged after 5 iterations. - iteration 16: trace = 11.0716751868834 (2.53346e-05% change) - linmin: converged after 5 iterations. - iteration 17: trace = 11.0716745609165 (5.65377e-06% change) - linmin: converged after 4 iterations. - iteration 18: trace = 11.07167451846614 (3.83414e-07% change) - linmin: converged after 4 iterations. - iteration 19: trace = 11.07167451467674 (3.42261e-08% change) - linmin: converged after 3 iterations. - iteration 20: trace = 11.07167451443791 (2.15707e-09% change) - linmin: converged after 4 iterations. - iteration 21: trace = 11.07167451439678 (3.71551e-10% change) - large trace change predicted (9.69785e-10%) - linmin: converged after 3 iterations. - iteration 22: trace = 11.07167451429157 (9.50263e-10% change) - large trace change predicted (4.92966e-09%) - linmin: converged after 3 iterations. - iteration 23: trace = 11.07167451374508 (4.93586e-09% change) - linmin: converged after 3 iterations. - iteration 24: trace = 11.07167451350822 (2.13939e-09% change) - linmin: converged after 3 iterations. - iteration 25: trace = 11.07167451349715 (9.9923e-11% change) -Finished solving for bands 2 to 8 after 25 iterations. + iteration 6: trace = 11.08249596585764 (0.00433693% change) + iteration 7: trace = 11.08219933088417 (0.00267664% change) + iteration 8: trace = 11.08039400153964 (0.0162917% change) + iteration 9: trace = 11.07371638757621 (0.0602833% change) + iteration 10: trace = 11.07251143754664 (0.0108818% change) + iteration 11: trace = 11.07220265219945 (0.0027888% change) + iteration 12: trace = 11.07213734891283 (0.000589797% change) + iteration 13: trace = 11.07212356897718 (0.000124456% change) + iteration 14: trace = 11.07210655936955 (0.000153626% change) + iteration 15: trace = 11.07200699121685 (0.000899274% change) + iteration 16: trace = 11.07178889190379 (0.00196985% change) + iteration 17: trace = 11.07169482776784 (0.000849588% change) + iteration 18: trace = 11.07167953803685 (0.000138098% change) + iteration 19: trace = 11.07167805058704 (1.34347e-05% change) + iteration 20: trace = 11.07167785219622 (1.79188e-06% change) + iteration 21: trace = 11.07167774763944 (9.44363e-07% change) + iteration 22: trace = 11.07167747619415 (2.45171e-06% change) + iteration 23: trace = 11.07167663774888 (7.57288e-06% change) + iteration 24: trace = 11.07167509233529 (1.39583e-05% change) + iteration 25: trace = 11.07167457643222 (4.65967e-06% change) + iteration 26: trace = 11.07167454093574 (3.20606e-07% change) + iteration 27: trace = 11.07167453781772 (2.81621e-08% change) + iteration 28: trace = 11.07167453682979 (8.92305e-09% change) + iteration 29: trace = 11.07167453596653 (7.79695e-09% change) + iteration 30: trace = 11.07167453222354 (3.38069e-08% change) + iteration 31: trace = 11.0716745217878 (9.42562e-08% change) + iteration 32: trace = 11.07167451532718 (5.83527e-08% change) + iteration 33: trace = 11.07167451385293 (1.33155e-08% change) + iteration 34: trace = 11.07167451367086 (1.64445e-09% change) + iteration 35: trace = 11.07167451366133 (8.61411e-11% change) +Finished solving for bands 2 to 8 after 35 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.468775, 0.546626, 0.989349, 1.02405, 1.49704, 1.51158, 1.99991 -elapsed time for k point: 0.004813671112060547 +elapsed time for k point: 0.005876779556274414 solve_kpoint (0.05,0,0): Solving for bands 1 to 8... linmin: converged after 9 iterations. - iteration 1: trace = 11.04205793869866 (0.320422% change) + iteration 1: trace = 11.04206547825641 (0.320456% change) linmin: converged after 11 iterations. - switching to approximate line minimization (decrease time by 54.2017%) - iteration 2: trace = 11.02779545072926 (0.129249% change) - iteration 3: trace = 11.02770667209143 (0.000805048% change) + switching to approximate line minimization (decrease time by 55.6314%) + iteration 2: trace = 11.02780272357469 (0.129251% change) + iteration 3: trace = 11.02771387702376 (0.000805663% change) switching back to exact line minimization - large trace change predicted (0.0933006%) + large trace change predicted (0.0933374%) linmin: converged after 10 iterations. - iteration 4: trace = 11.01806932935861 (0.0874303% change) - linmin: converged after 7 iterations. - iteration 5: trace = 11.01664588339096 (0.01292% change) + iteration 4: trace = 11.01807648287536 (0.0874307% change) + linmin: converged after 11 iterations. + iteration 5: trace = 11.0166529499266 (0.0129208% change) linmin: converged after 7 iterations. - iteration 6: trace = 11.01540534198435 (0.0112612% change) + iteration 6: trace = 11.01541217645437 (0.0112633% change) linmin: converged after 8 iterations. - iteration 7: trace = 11.01434100308328 (0.00966274% change) - linmin: converged after 7 iterations. - iteration 8: trace = 11.01352829466895 (0.00737891% change) + iteration 7: trace = 11.01434753653587 (0.00966547% change) linmin: converged after 6 iterations. - iteration 9: trace = 11.01297526221192 (0.00502152% change) + iteration 8: trace = 11.01353447909745 (0.00738208% change) + linmin: converged after 6 iterations. + iteration 9: trace = 11.01298118728499 (0.00502387% change) linmin: converged after 5 iterations. - iteration 10: trace = 11.01260521502363 (0.00336016% change) + iteration 10: trace = 11.01261098406042 (0.00336157% change) linmin: converged after 5 iterations. - iteration 11: trace = 11.01234752609954 (0.00233997% change) - linmin: converged after 6 iterations. - iteration 12: trace = 11.01215885812926 (0.00171325% change) + iteration 11: trace = 11.01235320183573 (0.00234082% change) linmin: converged after 6 iterations. - iteration 13: trace = 11.01201419275226 (0.0013137% change) + iteration 12: trace = 11.01216447507506 (0.00171379% change) linmin: converged after 5 iterations. - iteration 14: trace = 11.0118986833408 (0.00104895% change) + iteration 13: trace = 11.01201977058803 (0.00131405% change) linmin: converged after 5 iterations. - iteration 15: trace = 11.01180311430075 (0.000867874% change) - linmin: converged after 6 iterations. - iteration 16: trace = 11.01172148757471 (0.000741269% change) + iteration 14: trace = 11.01190423354244 (0.0010492% change) + linmin: converged after 7 iterations. + iteration 15: trace = 11.01180864559054 (0.000868046% change) linmin: converged after 5 iterations. - iteration 17: trace = 11.01164971491889 (0.000651786% change) + iteration 16: trace = 11.01172700484998 (0.000741395% change) linmin: converged after 5 iterations. - iteration 18: trace = 11.01158487888721 (0.000588797% change) + iteration 17: trace = 11.01165522196778 (0.000651879% change) linmin: converged after 5 iterations. - iteration 19: trace = 11.01152479432657 (0.00054565% change) - linmin: converged after 7 iterations. - iteration 20: trace = 11.01146773751677 (0.000518157% change) + iteration 18: trace = 11.01159037862589 (0.000588863% change) linmin: converged after 5 iterations. - iteration 21: trace = 11.01141227111394 (0.000503716% change) - linmin: converged after 6 iterations. - iteration 22: trace = 11.01135712712305 (0.000500791% change) + iteration 19: trace = 11.01153028883577 (0.000545697% change) linmin: converged after 5 iterations. - iteration 23: trace = 11.01130112530486 (0.000508584% change) + iteration 20: trace = 11.01147322846676 (0.000518189% change) linmin: converged after 6 iterations. - iteration 24: trace = 11.01124311550733 (0.000526822% change) + iteration 21: trace = 11.01141775990459 (0.000503736% change) + linmin: converged after 7 iterations. + iteration 22: trace = 11.0113626149082 (0.0005008% change) linmin: converged after 5 iterations. - iteration 25: trace = 11.01118193682011 (0.000555604% change) + iteration 23: trace = 11.01130661317064 (0.000508583% change) linmin: converged after 5 iterations. - iteration 26: trace = 11.01111639257797 (0.000595253% change) + iteration 24: trace = 11.0112486043141 (0.000526813% change) linmin: converged after 5 iterations. - iteration 27: trace = 11.01104523886382 (0.000646201% change) + iteration 25: trace = 11.01118742773753 (0.000555584% change) linmin: converged after 5 iterations. - iteration 28: trace = 11.01096718759072 (0.000708848% change) - linmin: converged after 6 iterations. - iteration 29: trace = 11.01088092871306 (0.000783394% change) - linmin: converged after 6 iterations. - iteration 30: trace = 11.0107851630937 (0.00086974% change) + iteration 26: trace = 11.01112188641354 (0.000595227% change) + linmin: converged after 5 iterations. + iteration 27: trace = 11.0110507365294 (0.000646166% change) linmin: converged after 5 iterations. - iteration 31: trace = 11.01067865281897 (0.000967331% change) + iteration 28: trace = 11.01097269037414 (0.000708801% change) + linmin: converged after 7 iterations. + iteration 29: trace = 11.01088643631825 (0.000783349% change) linmin: converged after 6 iterations. - iteration 32: trace = 11.01056027436562 (0.00107513% change) + iteration 30: trace = 11.0107906756356 (0.000869695% change) + linmin: converged after 7 iterations. + iteration 31: trace = 11.01068416984393 (0.00096729% change) linmin: converged after 6 iterations. - iteration 33: trace = 11.01042909082885 (0.00119144% change) + iteration 32: trace = 11.01056580081773 (0.00107504% change) linmin: converged after 6 iterations. - iteration 34: trace = 11.01028438213167 (0.0013143% change) + iteration 33: trace = 11.0104346174015 (0.00119144% change) linmin: converged after 5 iterations. - iteration 35: trace = 11.01012575003361 (0.00144077% change) - linmin: converged after 11 iterations. - iteration 36: trace = 11.00995310067744 (0.00156811% change) - linmin: converged after 10 iterations. - iteration 37: trace = 11.00976684084797 (0.00169175% change) + iteration 34: trace = 11.01028992142521 (0.00131418% change) linmin: converged after 7 iterations. - iteration 38: trace = 11.00956782195207 (0.00180767% change) - linmin: converged after 8 iterations. - iteration 39: trace = 11.00935750639113 (0.00191032% change) + iteration 35: trace = 11.01013127630571 (0.00144089% change) linmin: converged after 7 iterations. - iteration 40: trace = 11.00913805269041 (0.00199336% change) - linmin: converged after 5 iterations. - iteration 41: trace = 11.00891211948703 (0.00205225% change) - linmin: converged after 6 iterations. - iteration 42: trace = 11.00868302907584 (0.00208098% change) - linmin: converged after 8 iterations. - iteration 43: trace = 11.00845418498327 (0.00207878% change) - linmin: converged after 6 iterations. - iteration 44: trace = 11.0082288634682 (0.00204683% change) - linmin: converged after 8 iterations. - iteration 45: trace = 11.00800948032586 (0.00199292% change) + iteration 36: trace = 11.00995864637381 (0.00156793% change) linmin: converged after 7 iterations. - iteration 46: trace = 11.00779805169835 (0.0019207% change) + iteration 37: trace = 11.00977237798433 (0.00169183% change) + linmin: converged after 5 iterations. + iteration 38: trace = 11.00957334305518 (0.00180782% change) linmin: converged after 5 iterations. - iteration 47: trace = 11.00759555400522 (0.0018396% change) + iteration 39: trace = 11.00936295046565 (0.00191102% change) + linmin: converged after 5 iterations. + iteration 40: trace = 11.00914338016536 (0.00199442% change) linmin: converged after 7 iterations. - iteration 48: trace = 11.00740235538342 (0.00175515% change) + iteration 41: trace = 11.00891740071014 (0.00205267% change) linmin: converged after 6 iterations. - iteration 49: trace = 11.00721845442935 (0.00167072% change) - linmin: converged after 5 iterations. - iteration 50: trace = 11.00704341820571 (0.00159021% change) + iteration 42: trace = 11.0086882538385 (0.00208149% change) linmin: converged after 6 iterations. - iteration 51: trace = 11.00687665760919 (0.00151505% change) + iteration 43: trace = 11.00845934533058 (0.00207937% change) linmin: converged after 5 iterations. - iteration 52: trace = 11.00671759550665 (0.00144513% change) + iteration 44: trace = 11.00823385800568 (0.00204833% change) linmin: converged after 6 iterations. - iteration 53: trace = 11.00656557193216 (0.0013812% change) + iteration 45: trace = 11.00801440670718 (0.00199354% change) + linmin: converged after 8 iterations. + iteration 46: trace = 11.0078028421097 (0.00192193% change) linmin: converged after 6 iterations. - iteration 54: trace = 11.00642002912775 (0.00132234% change) + iteration 47: trace = 11.00760028478818 (0.00184014% change) + linmin: converged after 7 iterations. + iteration 48: trace = 11.0074070332745 (0.00175563% change) + linmin: converged after 5 iterations. + iteration 49: trace = 11.00722309034971 (0.0016711% change) linmin: converged after 6 iterations. - iteration 55: trace = 11.00628046534353 (0.00126803% change) + iteration 50: trace = 11.00704798591487 (0.00159083% change) linmin: converged after 6 iterations. - iteration 56: trace = 11.00614641270309 (0.00121797% change) + iteration 51: trace = 11.00688121596568 (0.00151513% change) linmin: converged after 6 iterations. - iteration 57: trace = 11.00601751766788 (0.00117113% change) + iteration 52: trace = 11.00672212615759 (0.00144538% change) linmin: converged after 5 iterations. - iteration 58: trace = 11.00589345873876 (0.0011272% change) - linmin: converged after 5 iterations. - iteration 59: trace = 11.00577397273525 (0.00108566% change) + iteration 53: trace = 11.00657009530096 (0.00138126% change) linmin: converged after 6 iterations. - iteration 60: trace = 11.00565885738997 (0.00104596% change) - linmin: converged after 5 iterations. - iteration 61: trace = 11.00554793915726 (0.00100783% change) - linmin: converged after 9 iterations. - iteration 62: trace = 11.00544107142036 (0.00097104% change) - linmin: converged after 5 iterations. - iteration 63: trace = 11.00533813187329 (0.000935356% change) + iteration 54: trace = 11.00642453205536 (0.00132252% change) + linmin: converged after 6 iterations. + iteration 55: trace = 11.00628495046748 (0.00126819% change) + linmin: converged after 6 iterations. + iteration 56: trace = 11.00615089230132 (0.00121802% change) + linmin: converged after 7 iterations. + iteration 57: trace = 11.00602198231146 (0.00117126% change) + linmin: converged after 11 iterations. + iteration 58: trace = 11.00589790083011 (0.0011274% change) + linmin: converged after 6 iterations. + iteration 59: trace = 11.00577840734076 (0.00108573% change) linmin: converged after 5 iterations. - iteration 64: trace = 11.0052390016318 (0.000900751% change) + iteration 60: trace = 11.00566328328333 (0.00104604% change) + linmin: converged after 7 iterations. + iteration 61: trace = 11.00555234903932 (0.00100798% change) linmin: converged after 5 iterations. - iteration 65: trace = 11.00514357009458 (0.00086715% change) + iteration 62: trace = 11.00544546463598 (0.000971191% change) linmin: converged after 5 iterations. - iteration 66: trace = 11.00505173535233 (0.000834475% change) + iteration 63: trace = 11.00534250308927 (0.000935555% change) + linmin: converged after 8 iterations. + iteration 64: trace = 11.00524334993483 (0.000900959% change) + linmin: converged after 6 iterations. + iteration 65: trace = 11.00514790080118 (0.00086731% change) linmin: converged after 7 iterations. - iteration 67: trace = 11.00496339318972 (0.000802745% change) + iteration 66: trace = 11.0050560440419 (0.000834674% change) + linmin: converged after 6 iterations. + iteration 67: trace = 11.0049676763415 (0.000802977% change) linmin: converged after 5 iterations. - iteration 68: trace = 11.00487842777363 (0.000772067% change) + iteration 68: trace = 11.00488268667282 (0.000772288% change) linmin: converged after 5 iterations. - iteration 69: trace = 11.00479672841493 (0.000742395% change) + iteration 69: trace = 11.00480096066358 (0.000742637% change) resetting CG direction... - large trace change predicted (0.115558%) - linmin: converged after 6 iterations. - iteration 70: trace = 10.9920204331813 (0.116165% change) - linmin: converged after 6 iterations. - iteration 71: trace = 10.9906218822864 (0.0127241% change) - linmin: converged after 6 iterations. - iteration 72: trace = 10.98948424872217 (0.0103515% change) + large trace change predicted (0.115616%) linmin: converged after 6 iterations. - iteration 73: trace = 10.98818656339612 (0.0118091% change) + iteration 70: trace = 10.99201826452346 (0.116223% change) linmin: converged after 6 iterations. - iteration 74: trace = 10.98802559588742 (0.00146492% change) - linmin: converged after 6 iterations. - iteration 75: trace = 10.98801515691552 (9.50032e-05% change) + iteration 71: trace = 10.99062033885502 (0.0127185% change) + linmin: converged after 5 iterations. + iteration 72: trace = 10.98948402917785 (0.0103394% change) linmin: converged after 6 iterations. - iteration 76: trace = 10.9880141270277 (9.37283e-06% change) - linmin: converged after 4 iterations. - iteration 77: trace = 10.98801409638141 (2.78907e-07% change) + iteration 73: trace = 10.98818687757013 (0.0118043% change) linmin: converged after 5 iterations. - iteration 78: trace = 10.98801409316273 (2.92927e-08% change) - linmin: converged after 4 iterations. - iteration 79: trace = 10.98801409305154 (1.01191e-09% change) + iteration 74: trace = 10.98802561054517 (0.00146765% change) + linmin: converged after 5 iterations. + iteration 75: trace = 10.98801515879121 (9.51195e-05% change) linmin: converged after 4 iterations. - iteration 80: trace = 10.98801409306347 (1.08621e-10% change) - large trace change predicted (7.26362e-10%) + iteration 76: trace = 10.98801412691842 (9.39089e-06% change) + linmin: converged after 7 iterations. + iteration 77: trace = 10.98801409647808 (2.77032e-07% change) linmin: converged after 3 iterations. - iteration 81: trace = 10.98801409297061 (8.45078e-10% change) + iteration 78: trace = 10.98801409322805 (2.9578e-08% change) + linmin: converged after 4 iterations. + iteration 79: trace = 10.98801409308742 (1.27985e-09% change) linmin: converged after 3 iterations. - iteration 82: trace = 10.98801409288025 (8.22429e-10% change) - linmin: converged after 35 iterations. - iteration 83: trace = 10.98801409291353 (3.02892e-10% change) + iteration 80: trace = 10.98801409306459 (2.07769e-10% change) + large trace change predicted (7.07419e-10%) linmin: converged after 3 iterations. - iteration 84: trace = 10.98801409303278 (1.08528e-09% change) + iteration 81: trace = 10.98801409287254 (1.74782e-09% change) + linmin: converged after 4 iterations. + iteration 82: trace = 10.98801409284531 (2.47813e-10% change) + linmin: converged after 8 iterations. + iteration 83: trace = 10.98801409282092 (2.21915e-10% change) + linmin: converged after 21 iterations. + iteration 84: trace = 10.98801409301135 (1.73308e-09% change) linmin: converged after 7 iterations. - iteration 85: trace = 10.98801409291102 (1.1081e-09% change) + iteration 85: trace = 10.98801409299876 (1.14635e-10% change) linmin: converged after 4 iterations. - iteration 86: trace = 10.98801409293177 (1.88871e-10% change) + iteration 86: trace = 10.98801409290762 (8.29429e-10% change) + linmin: converged after 3 iterations. + iteration 87: trace = 10.98801409301314 (9.60344e-10% change) + linmin: converged after 36 iterations. + iteration 88: trace = 10.9880140928082 (1.86517e-09% change) linmin: converged after 4 iterations. - iteration 87: trace = 10.98801409286466 (6.10812e-10% change) - linmin: converged after 19 iterations. - iteration 88: trace = 10.98801409294302 (7.13145e-10% change) - linmin: converged after 12 iterations. - iteration 89: trace = 10.98801409293512 (7.18431e-11% change) -Finished solving for bands 1 to 8 after 89 iterations. + iteration 89: trace = 10.98801409304132 (2.1216e-09% change) + linmin: converged after 7 iterations. + iteration 90: trace = 10.98801409292624 (1.04735e-09% change) + linmin: converged after 24 iterations. + iteration 91: trace = 10.98801409294622 (1.81855e-10% change) + linmin: converged after 34 iterations. + iteration 92: trace = 10.98801409286525 (7.36909e-10% change) + linmin: converged after 15 iterations. + iteration 93: trace = 10.98801409286777 (2.30047e-11% change) +Finished solving for bands 1 to 8 after 93 iterations. tmfreqs:, 2, 0.05, 0, 0, 0.05, 0.0235585, 0.461962, 0.553534, 0.976586, 1.03685, 1.4784, 1.53022, 1.97778 -elapsed time for k point: 0.020487546920776367 +elapsed time for k point: 0.027443408966064453 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. - iteration 1: trace = 10.90376046738741 (0.00793521% change) + iteration 1: trace = 10.90376046655852 (0.00793521% change) linmin: converged after 3 iterations. - iteration 2: trace = 10.90359830858333 (0.00148719% change) + iteration 2: trace = 10.90359830811457 (0.00148719% change) linmin: converged after 3 iterations. - iteration 3: trace = 10.90350960454564 (0.000813533% change) + iteration 3: trace = 10.90350960441305 (0.00081353% change) linmin: converged after 3 iterations. - iteration 4: trace = 10.90345230356217 (0.000525529% change) - linmin: converged after 3 iterations. - iteration 5: trace = 10.90344655289565 (5.27417e-05% change) + iteration 4: trace = 10.90345230355856 (0.000525528% change) + linmin: converged after 4 iterations. + iteration 5: trace = 10.90344655289588 (5.27417e-05% change) linmin: converged after 4 iterations. - iteration 6: trace = 10.90344608445383 (4.29627e-06% change) + iteration 6: trace = 10.90344608445385 (4.29627e-06% change) linmin: converged after 2 iterations. iteration 7: trace = 10.90344604871542 (3.27772e-07% change) linmin: converged after 2 iterations. - iteration 8: trace = 10.90344604735269 (1.24981e-08% change) + iteration 8: trace = 10.9034460473527 (1.24981e-08% change) linmin: converged after 2 iterations. - iteration 9: trace = 10.9034460473056 (4.31926e-10% change) + iteration 9: trace = 10.9034460473056 (4.31958e-10% change) linmin: converged after 2 iterations. - iteration 10: trace = 10.90344604730441 (1.08991e-11% change) + iteration 10: trace = 10.90344604730442 (1.08503e-11% change) Finished solving for bands 1 to 8 after 10 iterations. tmfreqs:, 3, 0.1, 0, 0, 0.1, 0.047044, 0.445964, 0.569827, 0.954549, 1.059, 1.45407, 1.55459, 1.95293 -elapsed time for k point: 0.0021486282348632812 +elapsed time for k point: 0.0027103424072265625 solve_kpoint (0.15,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. - iteration 1: trace = 10.82874318743389 (0.00713648% change) + iteration 1: trace = 10.828743187434 (0.00713648% change) linmin: converged after 3 iterations. - iteration 2: trace = 10.82865179048798 (0.000844025% change) - linmin: converged after 5 iterations. - iteration 3: trace = 10.82863914564312 (0.000116772% change) + iteration 2: trace = 10.82865179048805 (0.000844025% change) + linmin: converged after 4 iterations. + iteration 3: trace = 10.82863914564314 (0.000116772% change) linmin: converged after 5 iterations. iteration 4: trace = 10.82863201430638 (6.58563e-05% change) - linmin: converged after 5 iterations. - iteration 5: trace = 10.82863047384795 (1.42258e-05% change) + linmin: converged after 6 iterations. + iteration 5: trace = 10.82863047384796 (1.42258e-05% change) linmin: converged after 2 iterations. iteration 6: trace = 10.82863033630218 (1.2702e-06% change) linmin: converged after 2 iterations. iteration 7: trace = 10.82863032427763 (1.11044e-07% change) linmin: converged after 2 iterations. - iteration 8: trace = 10.82863032376797 (4.70658e-09% change) + iteration 8: trace = 10.82863032376797 (4.70655e-09% change) linmin: converged after 2 iterations. - iteration 9: trace = 10.82863032375329 (1.35548e-10% change) + iteration 9: trace = 10.82863032375329 (1.35581e-10% change) linmin: converged after 4 iterations. - iteration 10: trace = 10.82863032375297 (2.98558e-12% change) + iteration 10: trace = 10.82863032375297 (2.95277e-12% change) Finished solving for bands 1 to 8 after 10 iterations. tmfreqs:, 4, 0.15, 0, 0, 0.15, 0.0703703, 0.426194, 0.590125, 0.931007, 1.08275, 1.42941, 1.5793, 1.92803 -elapsed time for k point: 0.0022115707397460938 +elapsed time for k point: 0.0030546188354492188 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -6346,18 +6375,18 @@ linmin: converged after 5 iterations. iteration 4: trace = 10.76374528581931 (1.20535e-05% change) linmin: converged after 4 iterations. - iteration 5: trace = 10.76374486740369 (3.88727e-06% change) + iteration 5: trace = 10.7637448674037 (3.88727e-06% change) linmin: converged after 2 iterations. iteration 6: trace = 10.76374482182858 (4.23413e-07% change) linmin: converged after 2 iterations. - iteration 7: trace = 10.76374481723281 (4.26968e-08% change) + iteration 7: trace = 10.7637448172328 (4.26968e-08% change) linmin: converged after 2 iterations. - iteration 8: trace = 10.76374481699878 (2.17424e-09% change) + iteration 8: trace = 10.76374481699878 (2.17421e-09% change) linmin: converged after 2 iterations. iteration 9: trace = 10.76374481699274 (5.61437e-11% change) Finished solving for bands 1 to 8 after 9 iterations. tmfreqs:, 5, 0.2, 0, 0, 0.2, 0.0934195, 0.40505, 0.612091, 0.907101, 1.10696, 1.40468, 1.6041, 1.90311 -elapsed time for k point: 0.0019905567169189453 +elapsed time for k point: 0.0030853748321533203 solve_kpoint (0.25,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -6365,22 +6394,22 @@ linmin: converged after 4 iterations. iteration 2: trace = 10.70883098425239 (0.000730287% change) linmin: converged after 4 iterations. - iteration 3: trace = 10.70882611989432 (4.54238e-05% change) + iteration 3: trace = 10.70882611989433 (4.54238e-05% change) linmin: converged after 2 iterations. iteration 4: trace = 10.70882574797966 (3.47297e-06% change) linmin: converged after 2 iterations. - iteration 5: trace = 10.70882564389908 (9.71914e-07% change) + iteration 5: trace = 10.70882564389909 (9.71914e-07% change) linmin: converged after 2 iterations. iteration 6: trace = 10.70882562957837 (1.33728e-07% change) linmin: converged after 2 iterations. iteration 7: trace = 10.70882562792913 (1.54008e-08% change) linmin: converged after 2 iterations. - iteration 8: trace = 10.70882562781417 (1.0735e-09% change) + iteration 8: trace = 10.70882562781417 (1.07346e-09% change) linmin: converged after 2 iterations. - iteration 9: trace = 10.70882562781128 (2.69883e-11% change) + iteration 9: trace = 10.70882562781128 (2.70049e-11% change) Finished solving for bands 1 to 8 after 9 iterations. tmfreqs:, 6, 0.25, 0, 0, 0.25, 0.11601, 0.383577, 0.634793, 0.883153, 1.13136, 1.37995, 1.62894, 1.8782 -elapsed time for k point: 0.0019185543060302734 +elapsed time for k point: 0.002435922622680664 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -6390,27 +6419,27 @@ linmin: converged after 4 iterations. iteration 3: trace = 10.66388515749335 (4.13254e-05% change) linmin: converged after 2 iterations. - iteration 4: trace = 10.66388497807411 (1.68249e-06% change) + iteration 4: trace = 10.6638849780741 (1.68249e-06% change) linmin: converged after 2 iterations. iteration 5: trace = 10.66388495145453 (2.49624e-07% change) linmin: converged after 2 iterations. iteration 6: trace = 10.66388494762051 (3.59533e-08% change) linmin: converged after 2 iterations. - iteration 7: trace = 10.66388494718304 (4.10242e-09% change) + iteration 7: trace = 10.66388494718304 (4.10239e-09% change) linmin: converged after 2 iterations. - iteration 8: trace = 10.66388494713198 (4.78725e-10% change) + iteration 8: trace = 10.66388494713198 (4.78759e-10% change) linmin: converged after 2 iterations. - iteration 9: trace = 10.66388494713049 (1.40258e-11% change) + iteration 9: trace = 10.66388494713049 (1.40091e-11% change) Finished solving for bands 1 to 8 after 9 iterations. tmfreqs:, 7, 0.3, 0, 0, 0.3, 0.137834, 0.362445, 0.657758, 0.859352, 1.15583, 1.35526, 1.65379, 1.8533 -elapsed time for k point: 0.0019404888153076172 +elapsed time for k point: 0.0024366378784179688 solve_kpoint (0.35,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. iteration 1: trace = 10.62900860023463 (0.00703179% change) linmin: converged after 4 iterations. iteration 2: trace = 10.62893239530691 (0.000716955% change) - linmin: converged after 5 iterations. + linmin: converged after 4 iterations. iteration 3: trace = 10.62892818217895 (3.96383e-05% change) linmin: converged after 2 iterations. iteration 4: trace = 10.62892805633393 (1.18399e-06% change) @@ -6419,41 +6448,41 @@ linmin: converged after 2 iterations. iteration 6: trace = 10.62892804604186 (9.72511e-09% change) linmin: converged after 2 iterations. - iteration 7: trace = 10.62892804597542 (6.25063e-10% change) + iteration 7: trace = 10.62892804597543 (6.25013e-10% change) linmin: converged after 2 iterations. - iteration 8: trace = 10.62892804596423 (1.05272e-10% change) + iteration 8: trace = 10.62892804596423 (1.05339e-10% change) linmin: converged after 2 iterations. - iteration 9: trace = 10.62892804596352 (6.75184e-12% change) + iteration 9: trace = 10.62892804596352 (6.7017e-12% change) Finished solving for bands 1 to 8 after 9 iterations. tmfreqs:, 8, 0.35, 0, 0, 0.35, 0.15832, 0.342396, 0.6806, 0.835947, 1.18029, 1.33065, 1.67864, 1.82841 -elapsed time for k point: 0.0019164085388183594 +elapsed time for k point: 0.0024933815002441406 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. - iteration 1: trace = 10.60403759597598 (0.00704272% change) + iteration 1: trace = 10.60403759597599 (0.00704272% change) linmin: converged after 4 iterations. iteration 2: trace = 10.60396176516587 (0.000715115% change) linmin: converged after 5 iterations. iteration 3: trace = 10.6039576473093 (3.88332e-05% change) linmin: converged after 2 iterations. - iteration 4: trace = 10.60395754101095 (1.00244e-06% change) + iteration 4: trace = 10.60395754101094 (1.00244e-06% change) linmin: converged after 2 iterations. - iteration 5: trace = 10.60395753615697 (4.57752e-08% change) + iteration 5: trace = 10.60395753615696 (4.57752e-08% change) linmin: converged after 2 iterations. iteration 6: trace = 10.60395753572879 (4.03786e-09% change) linmin: converged after 2 iterations. - iteration 7: trace = 10.60395753570917 (1.85091e-10% change) + iteration 7: trace = 10.60395753570917 (1.85074e-10% change) linmin: converged after 2 iterations. - iteration 8: trace = 10.6039575357088 (3.43412e-12% change) + iteration 8: trace = 10.6039575357088 (3.40062e-12% change) Finished solving for bands 1 to 8 after 8 iterations. tmfreqs:, 9, 0.4, 0, 0, 0.4, 0.176334, 0.324651, 0.702682, 0.813501, 1.20459, 1.30625, 1.70347, 1.80356 -elapsed time for k point: 0.0017745494842529297 +elapsed time for k point: 0.002173185348510742 solve_kpoint (0.45,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. - iteration 1: trace = 10.58905458874505 (0.00704958% change) + iteration 1: trace = 10.58905458874506 (0.00704958% change) linmin: converged after 4 iterations. - iteration 2: trace = 10.58897895638373 (0.000714253% change) + iteration 2: trace = 10.58897895638372 (0.000714253% change) linmin: converged after 5 iterations. iteration 3: trace = 10.58897488550179 (3.84445e-05% change) linmin: converged after 2 iterations. @@ -6461,55 +6490,55 @@ linmin: converged after 2 iterations. iteration 5: trace = 10.58897478401991 (3.16888e-08% change) linmin: converged after 2 iterations. - iteration 6: trace = 10.58897478378886 (2.18198e-09% change) + iteration 6: trace = 10.58897478378886 (2.18206e-09% change) linmin: converged after 2 iterations. - iteration 7: trace = 10.58897478377234 (1.56029e-10% change) + iteration 7: trace = 10.58897478377234 (1.55945e-10% change) linmin: converged after 2 iterations. - iteration 8: trace = 10.58897478377203 (2.88539e-12% change) + iteration 8: trace = 10.58897478377203 (2.95249e-12% change) Finished solving for bands 1 to 8 after 8 iterations. tmfreqs:, 10, 0.45, 0, 0, 0.45, 0.189641, 0.31149, 0.722112, 0.793866, 1.22816, 1.28262, 1.72816, 1.77885 -elapsed time for k point: 0.0017294883728027344 +elapsed time for k point: 0.0022525787353515625 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. iteration 1: trace = 10.58406017889885 (0.00705116% change) linmin: converged after 4 iterations. iteration 2: trace = 10.58398461985988 (0.000713897% change) - linmin: converged after 5 iterations. - iteration 3: trace = 10.58398056403726 (3.83204e-05% change) + linmin: converged after 4 iterations. + iteration 3: trace = 10.58398056403727 (3.83204e-05% change) linmin: converged after 2 iterations. iteration 4: trace = 10.58398046806651 (9.06755e-07% change) linmin: converged after 2 iterations. iteration 5: trace = 10.58398046509703 (2.80564e-08% change) linmin: converged after 2 iterations. - iteration 6: trace = 10.58398046493153 (1.56371e-09% change) + iteration 6: trace = 10.58398046493153 (1.5637e-09% change) linmin: converged after 2 iterations. iteration 7: trace = 10.58398046491724 (1.34972e-10% change) linmin: converged after 1 iterations. - iteration 8: trace = 10.58398046491708 (1.49373e-12% change) + iteration 8: trace = 10.58398046491708 (1.47694e-12% change) Finished solving for bands 1 to 8 after 8 iterations. tmfreqs:, 11, 0.5, 0, 0, 0.5, 0.194775, 0.306403, 0.73165, 0.784262, 1.2441, 1.26666, 1.74884, 1.75817 -.elapsed time for k point: 0.001737356185913086 -Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.19477466366820295 at Vector3<0.5, 0.0, 0.0> -Band 2 range: 0.3064030262308435 at Vector3<0.5, 0.0, 0.0> to 0.468774852586742 at Vector3<0.0, 0.0, 0.0> -Band 3 range: 0.5466257501317185 at Vector3<0.0, 0.0, 0.0> to 0.731650442654164 at Vector3<0.5, 0.0, 0.0> -Band 4 range: 0.7842615905093817 at Vector3<0.5, 0.0, 0.0> to 0.9893486155437128 at Vector3<0.0, 0.0, 0.0> -Band 5 range: 1.0240548648147136 at Vector3<0.0, 0.0, 0.0> to 1.2440980042025864 at Vector3<0.5, 0.0, 0.0> -Band 6 range: 1.266656686185507 at Vector3<0.5, 0.0, 0.0> to 1.4970379696966218 at Vector3<0.0, 0.0, 0.0> -Band 7 range: 1.5115800994648734 at Vector3<0.0, 0.0, 0.0> to 1.7488359039910497 at Vector3<0.5, 0.0, 0.0> -Band 8 range: 1.758168320848364 at Vector3<0.5, 0.0, 0.0> to 1.9999072006788767 at Vector3<0.0, 0.0, 0.0> -Gap from band 1 (0.19477466366820295) to band 2 (0.3064030262308435), 44.54642128428587% -Gap from band 2 (0.468774852586742) to band 3 (0.5466257501317185), 15.33402626245283% -Gap from band 3 (0.731650442654164) to band 4 (0.7842615905093817), 6.941187444158468% -Gap from band 4 (0.9893486155437128) to band 5 (1.0240548648147136), 3.4475205401773166% -Gap from band 5 (1.2440980042025864) to band 6 (1.266656686185507), 1.7969642410134226% -Gap from band 6 (1.4970379696966218) to band 7 (1.5115800994648734), 0.966698293632494% -Gap from band 7 (1.7488359039910497) to band 8 (1.758168320848364), 0.5322158890607936% -total elapsed time for run: 0.04587268829345703 +.elapsed time for k point: 0.0021479129791259766 +Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.19477466366820304 at Vector3<0.5, 0.0, 0.0> +Band 2 range: 0.3064030262308446 at Vector3<0.5, 0.0, 0.0> to 0.468774852586679 at Vector3<0.0, 0.0, 0.0> +Band 3 range: 0.5466257501315631 at Vector3<0.0, 0.0, 0.0> to 0.7316504426541638 at Vector3<0.5, 0.0, 0.0> +Band 4 range: 0.7842615905093824 at Vector3<0.5, 0.0, 0.0> to 0.9893486155437031 at Vector3<0.0, 0.0, 0.0> +Band 5 range: 1.0240548648147256 at Vector3<0.0, 0.0, 0.0> to 1.244098004202587 at Vector3<0.5, 0.0, 0.0> +Band 6 range: 1.266656686185507 at Vector3<0.5, 0.0, 0.0> to 1.4970379696967233 at Vector3<0.0, 0.0, 0.0> +Band 7 range: 1.5115800994650521 at Vector3<0.0, 0.0, 0.0> to 1.7488359039910506 at Vector3<0.5, 0.0, 0.0> +Band 8 range: 1.7581683208483634 at Vector3<0.5, 0.0, 0.0> to 1.9999072007210579 at Vector3<0.0, 0.0, 0.0> +Gap from band 1 (0.19477466366820304) to band 2 (0.3064030262308446), 44.54642128428617% +Gap from band 2 (0.468774852586679) to band 3 (0.5466257501315631), 15.334026262437925% +Gap from band 3 (0.7316504426541638) to band 4 (0.7842615905093824), 6.941187444158583% +Gap from band 4 (0.9893486155437031) to band 5 (1.0240548648147256), 3.447520540179463% +Gap from band 5 (1.244098004202587) to band 6 (1.266656686185507), 1.7969642410133693% +Gap from band 6 (1.4970379696967233) to band 7 (1.5115800994650521), 0.9666982936375408% +Gap from band 7 (1.7488359039910506) to band 8 (1.7581683208483634), 0.532215889060705% +total elapsed time for run: 0.0604548454284668 done -/tmp/meepWcFBDI/test_bragg_sine-0: 0.05s +/tmp/meephWM0hz/test_bragg_sine-0: 0.06s -/tmp/meepWcFBDI/test_compute_field_energy-0 +/tmp/meephWM0hz/test_compute_field_energy-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -6552,7 +6581,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002295255661010742 +elapsed time for initialization: 0.002861499786376953 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -6663,7 +6692,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20144224166870117 +elapsed time for k point: 0.25754427909851074 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -6914,7 +6943,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.8567488193511963 +elapsed time for k point: 0.9092931747436523 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -6971,7 +7000,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.1381993293762207 +elapsed time for k point: 0.1801137924194336 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -7024,7 +7053,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12797808647155762 +elapsed time for k point: 0.16606593132019043 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -7085,7 +7114,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.15178155899047852 +elapsed time for k point: 0.19183945655822754 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -7170,7 +7199,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.2094869613647461 +elapsed time for k point: 0.27085113525390625 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -7241,7 +7270,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17368674278259277 +elapsed time for k point: 0.22368192672729492 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -7302,7 +7331,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14774346351623535 +elapsed time for k point: 0.1905965805053711 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -7355,7 +7384,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12716126441955566 +elapsed time for k point: 0.1512308120727539 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -7407,7 +7436,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12278294563293457 +elapsed time for k point: 0.12653088569641113 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -7459,7 +7488,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12218070030212402 +elapsed time for k point: 0.12041330337524414 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -7500,7 +7529,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09662914276123047 +elapsed time for k point: 0.09599900245666504 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -7547,7 +7576,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11277985572814941 +elapsed time for k point: 0.11084413528442383 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -7610,7 +7639,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.1528463363647461 +elapsed time for k point: 0.15246891975402832 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -7683,7 +7712,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.1792757511138916 +elapsed time for k point: 0.17978167533874512 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -7878,7 +7907,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.36011791229248047 +elapsed time for k point: 0.3704359531402588 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -7890,13 +7919,13 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.2842483520507812 +total elapsed time for run: 3.7016761302948 done Fixing h-field (band 8) phase by -1 + 2.59056e-07i; max ampl. = 4.48388 D-energy-components:, 16, 8, 0.499991, 0.500009, 0 -./tmp/meepWcFBDI/test_compute_field_energy-0: 3.29s +./tmp/meephWM0hz/test_compute_field_energy-0: 3.71s -/tmp/meepWcFBDI/test_compute_group_velocity-0 +/tmp/meephWM0hz/test_compute_group_velocity-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -7939,7 +7968,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002303600311279297 +elapsed time for initialization: 0.0023114681243896484 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -8050,7 +8079,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20247650146484375 +elapsed time for k point: 0.20203828811645508 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -8301,7 +8330,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6303014755249023 +elapsed time for k point: 0.624323844909668 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -8358,7 +8387,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13863086700439453 +elapsed time for k point: 0.13789939880371094 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -8411,7 +8440,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12794923782348633 +elapsed time for k point: 0.13228368759155273 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -8472,7 +8501,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14825153350830078 +elapsed time for k point: 0.15509581565856934 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -8557,7 +8586,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.20998454093933105 +elapsed time for k point: 0.2482898235321045 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -8628,7 +8657,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17401933670043945 +elapsed time for k point: 0.22142624855041504 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -8689,7 +8718,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14801025390625 +elapsed time for k point: 0.19304275512695312 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -8742,7 +8771,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12725567817687988 +elapsed time for k point: 0.15988945960998535 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -8794,7 +8823,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12203311920166016 +elapsed time for k point: 0.15218138694763184 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -8846,7 +8875,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12151098251342773 +elapsed time for k point: 0.1500835418701172 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -8887,7 +8916,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09581828117370605 +elapsed time for k point: 0.11880731582641602 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -8934,7 +8963,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.1112680435180664 +elapsed time for k point: 0.13973307609558105 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -8997,7 +9026,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.17127084732055664 +elapsed time for k point: 0.19251394271850586 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -9070,7 +9099,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17793059349060059 +elapsed time for k point: 0.23125958442687988 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -9265,7 +9294,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -.elapsed time for k point: 0.3559572696685791 +.elapsed time for k point: 0.4467587471008301 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -9277,11 +9306,11 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.0660064220428467 +total elapsed time for run: 3.5090651512145996 done -/tmp/meepWcFBDI/test_compute_group_velocity-0: 3.07s +/tmp/meephWM0hz/test_compute_group_velocity-0: 3.51s -/tmp/meepWcFBDI/test_compute_integrals-0 +/tmp/meephWM0hz/test_compute_integrals-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -9324,7 +9353,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0023589134216308594 +elapsed time for initialization: 0.0025131702423095703 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -9435,7 +9464,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20138049125671387 +elapsed time for k point: 0.2033705711364746 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -9686,7 +9715,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6254575252532959 +elapsed time for k point: 0.6219305992126465 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -9743,7 +9772,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13726377487182617 +elapsed time for k point: 0.13863468170166016 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -9796,7 +9825,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12835097312927246 +elapsed time for k point: 0.12699413299560547 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -9857,7 +9886,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14705181121826172 +elapsed time for k point: 0.14687490463256836 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -9942,7 +9971,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.2082538604736328 +elapsed time for k point: 0.2087113857269287 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -10013,7 +10042,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17275357246398926 +elapsed time for k point: 0.17241358757019043 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -10074,7 +10103,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.15606188774108887 +elapsed time for k point: 0.14762377738952637 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -10127,7 +10156,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12714934349060059 +elapsed time for k point: 0.12639784812927246 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -10179,7 +10208,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12215971946716309 +elapsed time for k point: 0.12097358703613281 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -10231,7 +10260,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.1216740608215332 +elapsed time for k point: 0.12016129493713379 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -10272,7 +10301,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09582877159118652 +elapsed time for k point: 0.09516286849975586 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -10319,7 +10348,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11210942268371582 +elapsed time for k point: 0.11138558387756348 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -10382,7 +10411,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.1531815528869629 +elapsed time for k point: 0.15183711051940918 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -10455,7 +10484,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.1791212558746338 +elapsed time for k point: 0.1779477596282959 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -10650,7 +10679,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.3593430519104004 +elapsed time for k point: 0.3595912456512451 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -10662,14 +10691,14 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.050529718399048 +total elapsed time for run: 3.033663034439087 done Fixing h-field (band 8) phase by -1 + 2.59056e-07i; max ampl. = 4.48388 H-energy-components:, 16, 8, 0, 0, 1 Fixing e-field (band 8) phase by 6.12323e-17 + -1i; max ampl. = 1.10099 -./tmp/meepWcFBDI/test_compute_integrals-0: 3.05s +./tmp/meephWM0hz/test_compute_integrals-0: 3.04s -/tmp/meepWcFBDI/test_diamond-0 +/tmp/meephWM0hz/test_diamond-0 ======================== Initializing eigensolver data Computing 5 bands with 1e-12 tolerance @@ -10729,7 +10758,7 @@ Vector3<0.325, 0.75, 0.425> Vector3<0.35, 0.75, 0.4> Vector3<0.375, 0.75, 0.375> -elapsed time for initialization: 0.052525997161865234 +elapsed time for initialization: 0.0536036491394043 solve_kpoint (0,0.5,0.5): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3, band 4, band 5 Solving for bands 1 to 5... @@ -10846,7 +10875,7 @@ iteration 54: trace = 1.074849119575324 (7.09403e-11% change) Finished solving for bands 1 to 5 after 54 iterations. freqs:, 1, 0, 0.5, 0.5, 1, 0.38015, 0.381243, 0.495263, 0.496788, 0.541208 -elapsed time for k point: 0.5725822448730469 +elapsed time for k point: 0.5746369361877441 solve_kpoint (0,0.525,0.475): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -10920,7 +10949,7 @@ iteration 34: trace = 1.072165029269352 (4.88961e-11% change) Finished solving for bands 1 to 5 after 34 iterations. freqs:, 2, 0, 0.525, 0.475, 1.0025, 0.380386, 0.382168, 0.495624, 0.497176, 0.537208 -elapsed time for k point: 0.35994625091552734 +elapsed time for k point: 0.3536956310272217 solve_kpoint (0,0.55,0.45): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -10985,7 +11014,7 @@ iteration 30: trace = 1.065499269609328 (4.31586e-11% change) Finished solving for bands 1 to 5 after 30 iterations. freqs:, 3, 0, 0.55, 0.45, 1.00995, 0.380966, 0.38483, 0.496711, 0.498342, 0.526501 -elapsed time for k point: 0.3798840045928955 +elapsed time for k point: 0.3129732608795166 solve_kpoint (0,0.575,0.425): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -11048,7 +11077,7 @@ iteration 29: trace = 1.057289565863228 (3.36861e-11% change) Finished solving for bands 1 to 5 after 29 iterations. freqs:, 4, 0, 0.575, 0.425, 1.02225, 0.381461, 0.388864, 0.498536, 0.500287, 0.511601 -elapsed time for k point: 0.3051571846008301 +elapsed time for k point: 0.3021080493927002 solve_kpoint (0,0.6,0.4): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -11109,7 +11138,7 @@ iteration 28: trace = 1.049127482148509 (7.79919e-11% change) Finished solving for bands 1 to 5 after 28 iterations. freqs:, 5, 0, 0.6, 0.4, 1.03923, 0.381077, 0.393446, 0.49495, 0.501109, 0.503014 -elapsed time for k point: 0.29767632484436035 +elapsed time for k point: 0.2968602180480957 solve_kpoint (0,0.625,0.375): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -11208,26 +11237,26 @@ iteration 45: trace = 1.041449455858893 (8.35346e-11% change) Finished solving for bands 1 to 5 after 45 iterations. freqs:, 6, 0, 0.625, 0.375, 1.06066, 0.378621, 0.396729, 0.479263, 0.504432, 0.506514 -elapsed time for k point: 0.4758884906768799 +elapsed time for k point: 0.47548627853393555 Fixing d-field (band 1) phase by 0.997721 + 0.0674732i; max ampl. = 12.9762 D-energy-components:, 6, 1, 0.0477669, 0.476092, 0.476141 -Outputting /tmp/meepWcFBDI/test_diamond-0-dpwr.k06.b01.h5... +Outputting /tmp/meephWM0hz/test_diamond-0-dpwr.k06.b01.h5... D-energy-components:, 6, 1, 0.0477669, 0.476092, 0.476141 Fixing d-field (band 2) phase by 0.997721 + 0.0674732i; max ampl. = 12.1515 D-energy-components:, 6, 2, 0.232067, 0.383937, 0.383996 -Outputting /tmp/meepWcFBDI/test_diamond-0-dpwr.k06.b02.h5... +Outputting /tmp/meephWM0hz/test_diamond-0-dpwr.k06.b02.h5... D-energy-components:, 6, 2, 0.232067, 0.383937, 0.383996 Fixing d-field (band 3) phase by 0.0674732 + -0.997721i; max ampl. = 13.3616 D-energy-components:, 6, 3, 0.736337, 0.13197, 0.131693 -Outputting /tmp/meepWcFBDI/test_diamond-0-dpwr.k06.b03.h5... +Outputting /tmp/meephWM0hz/test_diamond-0-dpwr.k06.b03.h5... D-energy-components:, 6, 3, 0.736337, 0.13197, 0.131693 Fixing d-field (band 4) phase by 0.997721 + 0.0674732i; max ampl. = 7.97913 D-energy-components:, 6, 4, 0.11714, 0.441055, 0.441805 -Outputting /tmp/meepWcFBDI/test_diamond-0-dpwr.k06.b04.h5... +Outputting /tmp/meephWM0hz/test_diamond-0-dpwr.k06.b04.h5... D-energy-components:, 6, 4, 0.11714, 0.441055, 0.441805 Fixing d-field (band 5) phase by -0.997721 + -0.0674732i; max ampl. = 12.8979 D-energy-components:, 6, 5, 0.238579, 0.435371, 0.32605 -Outputting /tmp/meepWcFBDI/test_diamond-0-dpwr.k06.b05.h5... +Outputting /tmp/meephWM0hz/test_diamond-0-dpwr.k06.b05.h5... D-energy-components:, 6, 5, 0.238579, 0.435371, 0.32605 solve_kpoint (0,0.6,0.3): Solving for bands 1 to 5... @@ -11322,7 +11351,7 @@ iteration 44: trace = 1.012177879712723 (7.98957e-11% change) Finished solving for bands 1 to 5 after 44 iterations. freqs:, 7, 0, 0.6, 0.3, 0.994987, 0.369582, 0.388559, 0.467091, 0.487657, 0.518291 -elapsed time for k point: 0.4683561325073242 +elapsed time for k point: 0.45506739616394043 solve_kpoint (0,0.575,0.225): Solving for bands 1 to 5... linmin: converged after 4 iterations. @@ -11531,7 +11560,7 @@ iteration 98: trace = 0.9843245962009872 (8.23031e-11% change) Finished solving for bands 1 to 5 after 98 iterations. freqs:, 8, 0, 0.575, 0.225, 0.940744, 0.356415, 0.3702, 0.457212, 0.470085, 0.538723 -elapsed time for k point: 1.017756700515747 +elapsed time for k point: 1.0124950408935547 solve_kpoint (0,0.55,0.15): Solving for bands 1 to 5... linmin: converged after 4 iterations. @@ -11592,7 +11621,7 @@ iteration 28: trace = 0.9576556548415067 (3.50576e-11% change) Finished solving for bands 1 to 5 after 28 iterations. freqs:, 9, 0, 0.55, 0.15, 0.9, 0.344555, 0.351994, 0.449598, 0.455588, 0.552575 -elapsed time for k point: 0.2950403690338135 +elapsed time for k point: 0.2947390079498291 solve_kpoint (0,0.525,0.075): Solving for bands 1 to 5... linmin: converged after 4 iterations. @@ -11651,7 +11680,7 @@ iteration 27: trace = 0.9411112540785541 (6.02823e-11% change) Finished solving for bands 1 to 5 after 27 iterations. freqs:, 10, 0, 0.525, 0.075, 0.874643, 0.336533, 0.339294, 0.444662, 0.446211, 0.562057 -elapsed time for k point: 0.28540682792663574 +elapsed time for k point: 0.2840158939361572 solve_kpoint (0,0.5,0): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -11706,7 +11735,7 @@ iteration 25: trace = 0.9357235187165454 (8.38252e-11% change) Finished solving for bands 1 to 5 after 25 iterations. freqs:, 11, 0, 0.5, 0, 0.866025, 0.333545, 0.334937, 0.442371, 0.443555, 0.565558 -elapsed time for k point: 0.2682182788848877 +elapsed time for k point: 0.2618706226348877 solve_kpoint (0,0.4,0): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -11757,7 +11786,7 @@ iteration 23: trace = 0.9457902789861149 (2.35241e-11% change) Finished solving for bands 1 to 5 after 23 iterations. freqs:, 12, 0, 0.4, 0, 0.69282, 0.299948, 0.301256, 0.47018, 0.471285, 0.567351 -elapsed time for k point: 0.24517393112182617 +elapsed time for k point: 0.2438201904296875 solve_kpoint (0,0.3,0): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -11810,7 +11839,7 @@ iteration 24: trace = 0.9752654193362962 (4.58198e-11% change) Finished solving for bands 1 to 5 after 24 iterations. freqs:, 13, 0, 0.3, 0, 0.519615, 0.235132, 0.236238, 0.517406, 0.518221, 0.572633 -elapsed time for k point: 0.25753140449523926 +elapsed time for k point: 0.25126123428344727 solve_kpoint (0,0.2,0): Solving for bands 1 to 5... linmin: converged after 7 iterations. @@ -11873,7 +11902,7 @@ iteration 29: trace = 1.01810313171719 (4.24634e-11% change) Finished solving for bands 1 to 5 after 29 iterations. freqs:, 14, 0, 0.2, 0, 0.34641, 0.160616, 0.161417, 0.560554, 0.560855, 0.580923 -elapsed time for k point: 0.3063199520111084 +elapsed time for k point: 0.42917466163635254 solve_kpoint (0,0.1,0): Solving for bands 1 to 5... linmin: converged after 13 iterations. @@ -11956,7 +11985,7 @@ iteration 39: trace = 1.053033028339033 (3.39699e-11% change) Finished solving for bands 1 to 5 after 39 iterations. freqs:, 15, 0, 0.1, 0, 0.173205, 0.0813864, 0.0818061, 0.587706, 0.587881, 0.59052 -elapsed time for k point: 0.41376662254333496 +elapsed time for k point: 0.537179708480835 solve_kpoint (0,0,0): Solving for bands 3 to 5... linmin: converged after 7 iterations. @@ -12021,7 +12050,7 @@ iteration 30: trace = 1.064751564401208 (6.97362e-11% change) Finished solving for bands 3 to 5 after 30 iterations. freqs:, 16, 0, 0, 0, 0, 0, 0, 0.59559, 0.595819, 0.595839 -elapsed time for k point: 0.15769100189208984 +elapsed time for k point: 0.20237350463867188 solve_kpoint (0,0.1,0.1): Solving for bands 1 to 5... linmin: converged after 8 iterations. @@ -12084,7 +12113,7 @@ iteration 29: trace = 1.0539009732219 (7.77229e-11% change) Finished solving for bands 1 to 5 after 29 iterations. freqs:, 17, 0, 0.1, 0.1, 0.2, 0.09409, 0.0944497, 0.585515, 0.585945, 0.591581 -elapsed time for k point: 0.31066083908081055 +elapsed time for k point: 0.39139509201049805 solve_kpoint (0,0.2,0.2): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -12153,7 +12182,7 @@ iteration 32: trace = 1.05069894559715 (7.02251e-11% change) Finished solving for bands 1 to 5 after 32 iterations. freqs:, 18, 0, 0.2, 0.2, 0.4, 0.185559, 0.18625, 0.566601, 0.567223, 0.582064 -elapsed time for k point: 0.3392984867095947 +elapsed time for k point: 0.4379401206970215 solve_kpoint (0,0.3,0.3): Solving for bands 1 to 5... linmin: converged after 4 iterations. @@ -12563,7 +12592,7 @@ iteration 196: trace = 1.068626506457554 (2.50589e-11% change) Finished solving for bands 1 to 5 after 196 iterations. freqs:, 19, 0, 0.3, 0.3, 0.6, 0.271029, 0.271988, 0.546939, 0.547286, 0.567915 -elapsed time for k point: 2.028233289718628 +elapsed time for k point: 2.6670660972595215 solve_kpoint (0,0.4,0.4): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -12800,7 +12829,7 @@ iteration 111: trace = 1.073945817633486 (7.47216e-11% change) Finished solving for bands 1 to 5 after 111 iterations. freqs:, 20, 0, 0.4, 0.4, 0.8, 0.343862, 0.344966, 0.517995, 0.519047, 0.546786 -elapsed time for k point: 1.1578919887542725 +elapsed time for k point: 1.5578632354736328 solve_kpoint (0,0.5,0.5): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -12881,7 +12910,7 @@ iteration 38: trace = 1.074849119556919 (9.57095e-11% change) Finished solving for bands 1 to 5 after 38 iterations. freqs:, 21, 0, 0.5, 0.5, 1, 0.38015, 0.381243, 0.495263, 0.496788, 0.541208 -elapsed time for k point: 0.40164756774902344 +elapsed time for k point: 0.5174198150634766 solve_kpoint (0.05,0.55,0.5): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -12997,7 +13026,7 @@ iteration 54: trace = 1.07229592142945 (8.17735e-11% change) Finished solving for bands 1 to 5 after 54 iterations. freqs:, 22, 0.05, 0.55, 0.5, 1.00499, 0.381309, 0.382411, 0.495948, 0.497425, 0.535972 -elapsed time for k point: 0.5672867298126221 +elapsed time for k point: 0.7250566482543945 solve_kpoint (0.1,0.6,0.5): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -13086,7 +13115,7 @@ iteration 41: trace = 1.068969912904174 (7.12266e-11% change) Finished solving for bands 1 to 5 after 41 iterations. freqs:, 23, 0.1, 0.6, 0.5, 1.0198, 0.384516, 0.385642, 0.497116, 0.498376, 0.526207 -elapsed time for k point: 0.43150997161865234 +elapsed time for k point: 0.5506415367126465 solve_kpoint (0.15,0.65,0.5): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -13178,7 +13207,7 @@ iteration 43: trace = 1.066421514875839 (5.37818e-11% change) Finished solving for bands 1 to 5 after 43 iterations. freqs:, 24, 0.15, 0.65, 0.5, 1.04403, 0.388899, 0.39006, 0.495493, 0.496211, 0.520859 -elapsed time for k point: 0.45387768745422363 +elapsed time for k point: 0.5702941417694092 solve_kpoint (0.2,0.7,0.5): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -13270,7 +13299,7 @@ iteration 42: trace = 1.064700418518055 (3.78312e-11% change) Finished solving for bands 1 to 5 after 42 iterations. freqs:, 25, 0.2, 0.7, 0.5, 1.07703, 0.392891, 0.394091, 0.490499, 0.490808, 0.523019 -elapsed time for k point: 0.4414668083190918 +elapsed time for k point: 0.45257568359375 solve_kpoint (0.25,0.75,0.5): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -13429,7 +13458,7 @@ iteration 73: trace = 1.065402852836689 (7.35284e-11% change) Finished solving for bands 1 to 5 after 73 iterations. freqs:, 26, 0.25, 0.75, 0.5, 1.11803, 0.394551, 0.395772, 0.487945, 0.488132, 0.526056 -elapsed time for k point: 0.7597751617431641 +elapsed time for k point: 0.7584438323974609 solve_kpoint (0.275,0.75,0.475): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -13518,7 +13547,7 @@ iteration 42: trace = 1.057545259395153 (4.76404e-11% change) Finished solving for bands 1 to 5 after 42 iterations. freqs:, 27, 0.275, 0.75, 0.475, 1.09772, 0.391745, 0.39651, 0.484446, 0.491809, 0.5199 -elapsed time for k point: 0.4445226192474365 +elapsed time for k point: 0.43807411193847656 solve_kpoint (0.3,0.75,0.45): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -13583,7 +13612,7 @@ iteration 30: trace = 1.048737747994243 (6.74346e-11% change) Finished solving for bands 1 to 5 after 30 iterations. freqs:, 28, 0.3, 0.75, 0.45, 1.08167, 0.387217, 0.396766, 0.481876, 0.494898, 0.514052 -elapsed time for k point: 0.31914258003234863 +elapsed time for k point: 0.3140428066253662 solve_kpoint (0.325,0.75,0.425): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -13654,7 +13683,7 @@ iteration 33: trace = 1.042055200585646 (5.93863e-11% change) Finished solving for bands 1 to 5 after 33 iterations. freqs:, 29, 0.325, 0.75, 0.425, 1.07005, 0.383285, 0.396393, 0.480245, 0.4979, 0.509391 -elapsed time for k point: 0.34855127334594727 +elapsed time for k point: 0.3471646308898926 solve_kpoint (0.35,0.75,0.4): Solving for bands 1 to 5... linmin: converged after 5 iterations. @@ -13737,7 +13766,7 @@ iteration 39: trace = 1.039345693140003 (8.32978e-11% change) Finished solving for bands 1 to 5 after 39 iterations. freqs:, 30, 0.35, 0.75, 0.4, 1.06301, 0.380687, 0.395955, 0.479389, 0.501411, 0.506376 -elapsed time for k point: 0.41026949882507324 +elapsed time for k point: 0.5061347484588623 solve_kpoint (0.375,0.75,0.375): Solving for bands 1 to 5... linmin: converged after 4 iterations. @@ -13853,18 +13882,18 @@ iteration 54: trace = 1.040877628560377 (8.59911e-11% change) Finished solving for bands 1 to 5 after 54 iterations. freqs:, 31, 0.375, 0.75, 0.375, 1.06066, 0.379784, 0.395774, 0.479133, 0.505118, 0.505264 -Felapsed time for k point: 0.566138744354248 +Felapsed time for k point: 0.726348876953125 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.3945510747904869 at Vector3<0.25, 0.75, 0.5> Band 2 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.3967657985676837 at Vector3<0.3, 0.75, 0.45> Band 3 range: 0.44237077092750754 at Vector3<0.0, 0.5, 0.0> to 0.5955899543441988 at Vector3<0.0, 0.0, 0.0> Band 4 range: 0.44355516364013836 at Vector3<0.0, 0.5, 0.0> to 0.5958191247379799 at Vector3<0.0, 0.0, 0.0> Band 5 range: 0.5030135898269759 at Vector3<0.0, 0.6, 0.4> to 0.5958386872987961 at Vector3<0.0, 0.0, 0.0> Gap from band 2 (0.3967657985676837) to band 3 (0.44237077092750754), 10.86949943970597% -total elapsed time for run: 15.15694522857666 +total elapsed time for run: 17.319979429244995 done -/tmp/meepWcFBDI/test_diamond-0: 15.16s +/tmp/meephWM0hz/test_diamond-0: 17.33s -/tmp/meepWcFBDI/test_epsilon_input_file-0 +/tmp/meephWM0hz/test_epsilon_input_file-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -13906,7 +13935,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0043070316314697266 +elapsed time for initialization: 0.007418155670166016 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -14035,7 +14064,7 @@ iteration 61: trace = 5.414470666068264 (7.20126e-11% change) Finished solving for bands 2 to 8 after 61 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.554399, 0.761333, 0.761334, 0.894089, 0.998343, 0.998344, 1.07475 -elapsed time for k point: 0.23806142807006836 +elapsed time for k point: 0.30566859245300293 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -14084,7 +14113,7 @@ iteration 22: trace = 5.384693219081497 (7.55613e-11% change) Finished solving for bands 1 to 8 after 22 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0879993, 0.552518, 0.748716, 0.762869, 0.888847, 0.992942, 0.998586, 1.07516 -elapsed time for k point: 0.1173391342163086 +elapsed time for k point: 0.1519908905029297 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -14127,7 +14156,7 @@ iteration 19: trace = 5.344827613715934 (7.50614e-11% change) Finished solving for bands 1 to 8 after 19 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.175173, 0.545105, 0.716013, 0.766968, 0.874229, 0.997272, 0.999271, 1.07644 -elapsed time for k point: 0.10212063789367676 +elapsed time for k point: 0.130112886428833 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -14174,7 +14203,7 @@ iteration 21: trace = 5.332538776580061 (2.57666e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.260381, 0.525802, 0.677399, 0.772205, 0.858581, 1.00023, 1.01596, 1.07856 -elapsed time for k point: 0.11182045936584473 +elapsed time for k point: 0.14264535903930664 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -14227,7 +14256,7 @@ iteration 24: trace = 5.352151659035265 (5.8646e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.341313, 0.485827, 0.650379, 0.776592, 0.84814, 1.00112, 1.04085, 1.08101 -elapsed time for k point: 0.1275489330291748 +elapsed time for k point: 0.16445207595825195 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -14298,7 +14327,7 @@ iteration 33: trace = 5.378204986194202 (9.65927e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.399713, 0.44029, 0.641795, 0.778307, 0.844568, 1.00149, 1.05803, 1.08222 -elapsed time for k point: 0.17449355125427246 +elapsed time for k point: 0.22168254852294922 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -14353,7 +14382,7 @@ iteration 25: trace = 5.280991714818072 (8.74221e-11% change) Finished solving for bands 1 to 8 after 25 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.410728, 0.444341, 0.636537, 0.78389, 0.839813, 0.968201, 1.03809, 1.08391 -elapsed time for k point: 0.1332077980041504 +elapsed time for k point: 0.16852784156799316 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -14402,7 +14431,7 @@ iteration 22: trace = 5.121436678029979 (6.86238e-11% change) Finished solving for bands 1 to 8 after 22 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.441866, 0.455742, 0.622718, 0.799069, 0.81865, 0.919493, 0.999313, 1.08532 -elapsed time for k point: 0.11691117286682129 +elapsed time for k point: 0.14974761009216309 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -14441,7 +14470,7 @@ iteration 17: trace = 4.989265495381124 (5.01476e-11% change) Finished solving for bands 1 to 8 after 17 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.472164, 0.488272, 0.604358, 0.769828, 0.821208, 0.893668, 0.95752, 1.08635 -elapsed time for k point: 0.09075498580932617 +elapsed time for k point: 0.11602902412414551 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -14478,7 +14507,7 @@ iteration 16: trace = 4.906005206120701 (8.87815e-11% change) Finished solving for bands 1 to 8 after 16 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.488979, 0.542408, 0.586566, 0.707953, 0.84869, 0.885188, 0.917534, 1.08708 -elapsed time for k point: 0.08657956123352051 +elapsed time for k point: 0.10965466499328613 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -14515,7 +14544,7 @@ iteration 16: trace = 4.877776571705256 (7.50015e-11% change) Finished solving for bands 1 to 8 after 16 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.497098, 0.578181, 0.578182, 0.668913, 0.878731, 0.883217, 0.88322, 1.08735 -elapsed time for k point: 0.08605265617370605 +elapsed time for k point: 0.10929059982299805 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -14552,7 +14581,7 @@ iteration 16: trace = 4.933541210214674 (4.65554e-11% change) Finished solving for bands 1 to 8 after 16 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.466856, 0.53849, 0.591576, 0.732347, 0.837964, 0.88299, 0.936299, 1.08665 -elapsed time for k point: 0.08617830276489258 +elapsed time for k point: 0.1081240177154541 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -14597,7 +14626,7 @@ iteration 20: trace = 5.086788979299675 (3.48162e-11% change) Finished solving for bands 1 to 8 after 20 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.365915, 0.534301, 0.628951, 0.8052, 0.817085, 0.882667, 1.0025, 1.08247 -elapsed time for k point: 0.10655403137207031 +elapsed time for k point: 0.12379145622253418 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -14652,7 +14681,7 @@ iteration 25: trace = 5.263256512288836 (3.39526e-11% change) Finished solving for bands 1 to 8 after 25 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.247333, 0.542781, 0.682198, 0.781369, 0.883491, 0.892769, 1.05714, 1.06602 -elapsed time for k point: 0.2500433921813965 +elapsed time for k point: 0.13842201232910156 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -14711,7 +14740,7 @@ iteration 27: trace = 5.362887848881175 (8.61533e-11% change) Finished solving for bands 1 to 8 after 27 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.124412, 0.55106, 0.736012, 0.76647, 0.888039, 0.959199, 1.0268, 1.07311 -elapsed time for k point: 0.14280033111572266 +elapsed time for k point: 0.13996028900146484 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -14789,7 +14818,7 @@ iteration 36: trace = 5.414470666066691 (4.42246e-11% change) Finished solving for bands 2 to 8 after 36 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.554399, 0.761333, 0.761334, 0.894089, 0.998343, 0.998344, 1.07475 -F.elapsed time for k point: 0.1404581069946289 +F.elapsed time for k point: 0.13904666900634766 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.4970977843772993 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4402896410505964 at Vector3<0.5, 0.0, 0.0> to 0.5781812856814899 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5781815082009814 at Vector3<0.5, 0.5, 0.0> to 0.7613327775255612 at Vector3<0.0, 0.0, 0.0> @@ -14801,15 +14830,15 @@ Gap from band 2 (0.5781812856814899) to band 3 (0.5781815082009814), 3.8486103613284535e-05% Gap from band 4 (0.8051999839699244) to band 5 (0.8170847453549143), 1.4651880980148324% Gap from band 7 (1.058030983248979) to band 8 (1.0660233597945297), 0.7525585747583696% -total elapsed time for run: 2.116206407546997 +total elapsed time for run: 2.427669048309326 done -/tmp/meepWcFBDI/test_epsilon_input_file-0: 2.12s +/tmp/meephWM0hz/test_epsilon_input_file-0: 2.43s -/tmp/meepWcFBDI/test_first_brillouin_zone-0 +/tmp/meephWM0hz/test_first_brillouin_zone-0 ======================== -/tmp/meepWcFBDI/test_first_brillouin_zone-0: 0.09s +/tmp/meephWM0hz/test_first_brillouin_zone-0: 0.11s -/tmp/meepWcFBDI/test_fractional_lattice-0 +/tmp/meephWM0hz/test_fractional_lattice-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -14852,7 +14881,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0002353191375732422 +elapsed time for initialization: 0.00024771690368652344 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -14861,146 +14890,144 @@ linmin: converged after 7 iterations. iteration 2: trace = 83.85049109174223 (11.9223% change) linmin: converged after 5 iterations. - switching to approximate line minimization (decrease time by 51.087%) + switching to approximate line minimization (decrease time by 57.0093%) iteration 3: trace = 83.3461110942817 (0.603338% change) iteration 4: trace = 83.33359978597117 (0.0150124% change) iteration 5: trace = 83.33333949085062 (0.000312354% change) - switching back to exact line minimization iteration 6: trace = 83.3333335246606 (7.15943e-06% change) - linmin: converged after 2 iterations. - iteration 7: trace = 83.33333333657039 (2.25708e-07% change) - linmin: converged after 2 iterations. - iteration 8: trace = 83.33333333338273 (3.8252e-09% change) - linmin: converged after 2 iterations. - iteration 9: trace = 83.33333333333454 (5.78268e-11% change) + iteration 7: trace = 83.33333333657075 (2.25708e-07% change) + iteration 8: trace = 83.33333333338291 (3.8254e-09% change) + iteration 9: trace = 83.33333333333468 (5.7878e-11% change) Finished solving for bands 2 to 8 after 9 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 2.88675, 2.88675, 2.88675, 2.88675, 4.08248, 4.08248, 4.08248 -elapsed time for k point: 0.0018858909606933594 +elapsed time for k point: 0.002001047134399414 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 10 iterations. - iteration 1: trace = 82.33333333334656 (0.722248% change) + iteration 1: trace = 82.33333333334654 (0.722248% change) linmin: converged after 2 iterations. - iteration 2: trace = 82.33333333333378 (1.55169e-11% change) + iteration 2: trace = 82.3333333333338 (1.54824e-11% change) Finished solving for bands 1 to 8 after 2 iterations. tefreqs:, 2, 0.1, 0, 0, 1, 0.288675, 2.59808, 2.90115, 2.90115, 3.17543, 3.88373, 3.88373, 4.29146 -elapsed time for k point: 0.0012238025665283203 +elapsed time for k point: 0.0013225078582763672 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. - iteration 1: trace = 82.66666666666671 (5.50098e-13% change) + iteration 1: trace = 82.66666666666671 (5.32907e-13% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 3, 0.2, 0, 0, 2, 0.57735, 2.3094, 2.94392, 2.94392, 3.4641, 3.69685, 3.69685, 4.50925 -elapsed time for k point: 0.0002548694610595703 +elapsed time for k point: 0.0002613067626953125 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. - iteration 1: trace = 84.33333333333331 (5.05524e-14% change) + iteration 1: trace = 84.33333333333333 (3.37016e-14% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 4, 0.3, 0, 0, 3, 0.866025, 2.02073, 3.01386, 3.01386, 3.52373, 3.52373, 3.75278, 4.73462 -elapsed time for k point: 0.00024056434631347656 +elapsed time for k point: 0.00025153160095214844 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. - iteration 1: trace = 87.3333333333333 (4.88159e-14% change) + iteration 1: trace = 87.33333333333329 (4.88159e-14% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 5, 0.4, 0, 0, 4, 1.1547, 1.73205, 3.10913, 3.10913, 3.3665, 3.3665, 4.04145, 4.96655 -elapsed time for k point: 0.00023984909057617188 +elapsed time for k point: 0.000244140625 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... - linmin: converged after 1 iterations. - iteration 1: trace = 91.66666666666667 (1.55028e-14% change) + linmin: converged after 6 iterations. + switching to approximate line minimization (decrease time by 54.4715%) + iteration 1: trace = 91.66666666666664 (0% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 6, 0.5, 0, 0, 5, 1.44338, 1.44338, 3.22749, 3.22749, 3.22749, 3.22749, 4.33013, 5.20416 -elapsed time for k point: 0.0002338886260986328 +elapsed time for k point: 0.0002849102020263672 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... near maximum in trace linmin: converged after 8 iterations. - switching to approximate line minimization (decrease time by 61.3793%) - iteration 1: trace = 90.66666666668115 (3.571% change) - iteration 2: trace = 90.66666682539491 (1.75052e-07% change) - iteration 3: trace = 90.66666666666676 (1.75068e-07% change) - iteration 4: trace = 90.66666666666669 (7.83687e-14% change) + switching to approximate line minimization (decrease time by 61.1111%) + iteration 1: trace = 90.66666666677224 (3.571% change) + iteration 2: trace = 90.66666784145588 (1.29561e-06% change) + iteration 3: trace = 90.66666666666723 (1.29572e-06% change) + iteration 4: trace = 90.66666666666669 (5.95602e-13% change) Finished solving for bands 1 to 8 after 4 iterations. tefreqs:, 7, 0.5, 0.1, 0, 5.09902, 1.47196, 1.47196, 2.97209, 2.97209, 3.48807, 3.48807, 4.33974, 5.04975 -elapsed time for k point: 0.0005347728729248047 +elapsed time for k point: 0.0005481243133544922 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. - iteration 1: trace = 90.99999999999999 (3.12326e-14% change) + iteration 1: trace = 91.00000000000001 (4.6849e-14% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 8, 0.5, 0.2, 0, 5.38516, 1.55456, 1.55456, 2.72336, 2.72336, 3.75278, 3.75278, 4.36845, 4.90748 -elapsed time for k point: 0.00023508071899414062 +elapsed time for k point: 0.0002894401550292969 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... - linmin: converged after 1 iterations. - iteration 1: trace = 92.66666666666666 (0% change) + linmin: converged after 42 iterations. + iteration 1: trace = 92.66666666666666 (3.06709e-14% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 9, 0.5, 0.3, 0, 5.83095, 1.68325, 1.68325, 2.48328, 2.48328, 4.02078, 4.02078, 4.41588, 4.77842 -elapsed time for k point: 0.0002346038818359375 +elapsed time for k point: 0.0007572174072265625 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. - iteration 1: trace = 95.6666666666667 (7.42728e-14% change) + iteration 1: trace = 95.66666666666664 (2.97091e-14% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 10, 0.5, 0.4, 0, 6.40312, 1.84842, 1.84842, 2.25462, 2.25462, 4.29146, 4.29146, 4.48144, 4.66369 -elapsed time for k point: 0.00023412704467773438 +elapsed time for k point: 0.00024271011352539062 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. - iteration 1: trace = 99.99999999999997 (1.42109e-14% change) + iteration 1: trace = 100 (0% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 11, 0.5, 0.5, 0, 7.07107, 2.04124, 2.04124, 2.04124, 2.04124, 4.56435, 4.56435, 4.56435, 4.56435 -elapsed time for k point: 0.00023126602172851562 +elapsed time for k point: 0.00023603439331054688 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... - linmin: converged after 3 iterations. - iteration 1: trace = 91.33333333333334 (4.6678e-14% change) + linmin: converged after 1 iterations. + iteration 1: trace = 91.33333333333333 (0% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 12, 0.4, 0.4, 0, 5.65685, 1.63299, 2.08167, 2.08167, 2.44949, 4.20317, 4.20317, 4.39697, 4.39697 -elapsed time for k point: 0.0002510547637939453 +elapsed time for k point: 0.00023937225341796875 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... - linmin: converged after 32 iterations. - iteration 1: trace = 85.33333333333334 (1.66533e-14% change) + linmin: converged after 44 iterations. + switching to approximate line minimization (decrease time by 86.9955%) + iteration 1: trace = 85.33333333333333 (1.66533e-14% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 13, 0.3, 0.3, 0, 4.24264, 1.22474, 2.19848, 2.19848, 2.85774, 3.85141, 3.85141, 4.26224, 4.26224 -elapsed time for k point: 0.0005140304565429688 +elapsed time for k point: 0.0006120204925537109 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... - linmin: converged after 1 iterations. - iteration 1: trace = 81.99999999999999 (1.73303e-14% change) + linmin: converged after 3 iterations. + iteration 1: trace = 81.99999999999997 (1.73303e-14% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 14, 0.2, 0.2, 0, 2.82843, 0.816497, 2.38048, 2.38048, 3.26599, 3.51188, 3.51188, 4.16333, 4.16333 -elapsed time for k point: 0.00023651123046875 +elapsed time for k point: 0.00026154518127441406 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... - linmin: converged after 33 iterations. - iteration 1: trace = 81.33333333333333 (1.74724e-14% change) + linmin: converged after 5 iterations. + iteration 1: trace = 81.3333333333333 (5.24171e-14% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 15, 0.1, 0.1, 0, 1.41421, 0.408248, 2.61406, 2.61406, 3.18852, 3.18852, 3.67423, 4.10284, 4.10284 -elapsed time for k point: 0.0005230903625488281 +elapsed time for k point: 0.00027489662170410156 solve_kpoint (0,0,0): Solving for bands 2 to 8... - linmin: converged after 1 iterations. - iteration 1: trace = 83.33333333333337 (6.82121e-14% change) + linmin: converged after 3 iterations. + iteration 1: trace = 83.33333333333334 (3.41061e-14% change) Finished solving for bands 2 to 8 after 1 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 2.88675, 2.88675, 2.88675, 2.88675, 4.08248, 4.08248, 4.08248 -.elapsed time for k point: 0.0002040863037109375 +.elapsed time for k point: 0.00022125244140625 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 2.0412414523193134 at Vector3<0.5, 0.5, 0.0> -Band 2 range: 1.4433756729740652 at Vector3<0.5, 0.0, 0.0> to 2.88675134594814 at Vector3<0.0, 0.0, 0.0> -Band 3 range: 2.041241452319315 at Vector3<0.5, 0.5, 0.0> to 3.227486121839512 at Vector3<0.5, 0.0, 0.0> -Band 4 range: 2.041241452319316 at Vector3<0.5, 0.5, 0.0> to 3.2659863237109072 at Vector3<0.19999999999999996, 0.19999999999999996, 0.0> -Band 5 range: 2.8867513459481287 at Vector3<0.0, 0.0, 0.0> to 4.564354645876381 at Vector3<0.5, 0.5, 0.0> -Band 6 range: 3.227486121839515 at Vector3<0.5, 0.0, 0.0> to 4.564354645876383 at Vector3<0.5, 0.5, 0.0> -Band 7 range: 3.696845502136474 at Vector3<0.2, 0.0, 0.0> to 4.564354645876385 at Vector3<0.5, 0.5, 0.0> -Band 8 range: 4.082482904638633 at Vector3<0.0, 0.0, 0.0> to 5.204164998665332 at Vector3<0.5, 0.0, 0.0> -total elapsed time for run: 0.007768869400024414 +Band 2 range: 1.4433756729740652 at Vector3<0.5, 0.0, 0.0> to 2.886751345948134 at Vector3<0.0, 0.0, 0.0> +Band 3 range: 2.0412414523193148 at Vector3<0.5, 0.5, 0.0> to 3.2274861218395126 at Vector3<0.5, 0.0, 0.0> +Band 4 range: 2.0412414523193156 at Vector3<0.5, 0.5, 0.0> to 3.265986323710902 at Vector3<0.19999999999999996, 0.19999999999999996, 0.0> +Band 5 range: 2.8867513459481295 at Vector3<0.0, 0.0, 0.0> to 4.564354645876382 at Vector3<0.5, 0.5, 0.0> +Band 6 range: 3.2274861218395166 at Vector3<0.5, 0.0, 0.0> to 4.564354645876383 at Vector3<0.5, 0.5, 0.0> +Band 7 range: 3.696845502136472 at Vector3<0.2, 0.0, 0.0> to 4.564354645876384 at Vector3<0.5, 0.5, 0.0> +Band 8 range: 4.08248290463863 at Vector3<0.0, 0.0, 0.0> to 5.204164998665332 at Vector3<0.5, 0.0, 0.0> +total elapsed time for run: 0.008651494979858398 done -/tmp/meepWcFBDI/test_fractional_lattice-0: 0.01s +/tmp/meephWM0hz/test_fractional_lattice-0: 0.01s -/tmp/meepWcFBDI/test_get_bfield-0 +/tmp/meephWM0hz/test_get_bfield-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -15043,7 +15070,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002323627471923828 +elapsed time for initialization: 0.002335786819458008 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -15154,7 +15181,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.2029275894165039 +elapsed time for k point: 0.2027125358581543 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -15405,7 +15432,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6287589073181152 +elapsed time for k point: 0.6229715347290039 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -15462,7 +15489,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13779497146606445 +elapsed time for k point: 0.13578581809997559 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -15515,7 +15542,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.1268632411956787 +elapsed time for k point: 0.12550854682922363 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -15576,7 +15603,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.1468043327331543 +elapsed time for k point: 0.14684271812438965 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -15661,7 +15688,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.20893144607543945 +elapsed time for k point: 0.20511794090270996 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -15732,7 +15759,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.1736464500427246 +elapsed time for k point: 0.16975617408752441 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -15793,7 +15820,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.1477646827697754 +elapsed time for k point: 0.1448204517364502 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -15846,7 +15873,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12752485275268555 +elapsed time for k point: 0.1246497631072998 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -15898,7 +15925,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12303328514099121 +elapsed time for k point: 0.12025046348571777 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -15950,7 +15977,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12178540229797363 +elapsed time for k point: 0.11946702003479004 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -15991,7 +16018,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09664607048034668 +elapsed time for k point: 0.09440422058105469 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -16038,7 +16065,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.1120450496673584 +elapsed time for k point: 0.11011719703674316 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -16101,7 +16128,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.1540515422821045 +elapsed time for k point: 0.14942717552185059 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -16174,7 +16201,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.18292450904846191 +elapsed time for k point: 0.17487311363220215 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -16369,7 +16396,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.3624236583709717 +elapsed time for k point: 0.35407090187072754 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -16381,12 +16408,12 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.057204008102417 +total elapsed time for run: 3.004218816757202 done Fixing b-field (band 8) phase by -1 + 2.59056e-07i; max ampl. = 4.48388 -./tmp/meepWcFBDI/test_get_bfield-0: 3.06s +./tmp/meephWM0hz/test_get_bfield-0: 3.01s -/tmp/meepWcFBDI/test_get_dfield-0 +/tmp/meephWM0hz/test_get_dfield-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -16429,7 +16456,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002396106719970703 +elapsed time for initialization: 0.0022602081298828125 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -16540,7 +16567,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20278596878051758 +elapsed time for k point: 0.19941449165344238 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -16791,7 +16818,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6282672882080078 +elapsed time for k point: 0.6166040897369385 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -16848,7 +16875,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13767123222351074 +elapsed time for k point: 0.13522744178771973 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -16901,7 +16928,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.1274094581604004 +elapsed time for k point: 0.1252579689025879 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -16962,7 +16989,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14749455451965332 +elapsed time for k point: 0.14598464965820312 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -17047,7 +17074,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.4382045269012451 +elapsed time for k point: 0.2051856517791748 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -17118,7 +17145,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17389369010925293 +elapsed time for k point: 0.1701822280883789 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -17179,7 +17206,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14738059043884277 +elapsed time for k point: 0.1449289321899414 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -17232,7 +17259,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12622666358947754 +elapsed time for k point: 0.12488412857055664 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -17284,7 +17311,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.1210787296295166 +elapsed time for k point: 0.11978888511657715 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -17336,7 +17363,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12063097953796387 +elapsed time for k point: 0.11978721618652344 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -17377,7 +17404,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09562206268310547 +elapsed time for k point: 0.0946657657623291 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -17424,7 +17451,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11115455627441406 +elapsed time for k point: 0.10990166664123535 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -17487,7 +17514,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15189504623413086 +elapsed time for k point: 0.15175843238830566 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -17560,7 +17587,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.1772611141204834 +elapsed time for k point: 0.1758100986480713 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -17755,7 +17782,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.3548455238342285 +elapsed time for k point: 0.3564627170562744 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -17767,12 +17794,12 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.265164375305176 +total elapsed time for run: 2.9991438388824463 done Fixing d-field (band 8) phase by 2.59056e-07 + 1i; max ampl. = 8.66842 -./tmp/meepWcFBDI/test_get_dfield-0: 3.27s +./tmp/meephWM0hz/test_get_dfield-0: 3.00s -/tmp/meepWcFBDI/test_get_efield-0 +/tmp/meephWM0hz/test_get_efield-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -17815,7 +17842,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002315044403076172 +elapsed time for initialization: 0.002249002456665039 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -17926,7 +17953,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20085382461547852 +elapsed time for k point: 0.1996932029724121 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -18177,7 +18204,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6218268871307373 +elapsed time for k point: 0.62148118019104 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18234,7 +18261,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.1363999843597412 +elapsed time for k point: 0.13642644882202148 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18287,7 +18314,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.1259918212890625 +elapsed time for k point: 0.16137051582336426 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18348,7 +18375,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14659476280212402 +elapsed time for k point: 0.20222163200378418 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18433,7 +18460,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.2074284553527832 +elapsed time for k point: 0.27696752548217773 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -18504,7 +18531,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.1716468334197998 +elapsed time for k point: 0.2279644012451172 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18565,7 +18592,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14606332778930664 +elapsed time for k point: 0.19553422927856445 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18618,7 +18645,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12594819068908691 +elapsed time for k point: 0.16621899604797363 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18670,7 +18697,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12381148338317871 +elapsed time for k point: 0.1604454517364502 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18722,7 +18749,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12079977989196777 +elapsed time for k point: 0.15897369384765625 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18763,7 +18790,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09585070610046387 +elapsed time for k point: 0.12507963180541992 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18810,7 +18837,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11087322235107422 +elapsed time for k point: 0.1432032585144043 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18873,7 +18900,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15172767639160156 +elapsed time for k point: 0.18079042434692383 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -18946,7 +18973,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17754316329956055 +elapsed time for k point: 0.1837329864501953 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -19141,7 +19168,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.3561391830444336 +elapsed time for k point: 0.36002111434936523 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -19153,12 +19180,12 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.0227181911468506 +total elapsed time for run: 3.503610610961914 done Fixing e-field (band 8) phase by 2.59056e-07 + 1i; max ampl. = 1.10099 -./tmp/meepWcFBDI/test_get_efield-0: 3.03s +./tmp/meephWM0hz/test_get_efield-0: 3.51s -/tmp/meepWcFBDI/test_get_eigenvectors-0 +/tmp/meephWM0hz/test_get_eigenvectors-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -19201,7 +19228,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002358675003051758 +elapsed time for initialization: 0.0024094581604003906 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -19312,7 +19339,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.2025144100189209 +elapsed time for k point: 0.20405030250549316 Fixing h-field (band 1) phase by 1 + -0i; max ampl. = 1 Fixing h-field (band 2) phase by 0.791203 + 0.611554i; max ampl. = 5.12967 Fixing h-field (band 3) phase by -0.804161 + -0.594412i; max ampl. = 4.27896 @@ -19571,7 +19598,7 @@ iteration 121: trace = 5.540497242579404 (3.79766e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6277351379394531 +elapsed time for k point: 0.6277921199798584 Fixing h-field (band 1) phase by -1 + 2.59196e-07i; max ampl. = 1.02721 Fixing h-field (band 2) phase by -0.999999 + 0.00113305i; max ampl. = 5.09036 Fixing h-field (band 3) phase by 0.00042147 + -1i; max ampl. = 3.73536 @@ -19636,7 +19663,7 @@ iteration 26: trace = 5.499374946276076 (6.76061e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13758087158203125 +elapsed time for k point: 0.2930448055267334 Fixing h-field (band 1) phase by 1 + -4.11211e-12i; max ampl. = 1.11365 Fixing h-field (band 2) phase by -1 + 5.18691e-09i; max ampl. = 4.92243 Fixing h-field (band 3) phase by -1.10145e-09 + 1i; max ampl. = 2.65638 @@ -19697,7 +19724,7 @@ iteration 24: trace = 5.48545908008786 (6.14953e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12766051292419434 +elapsed time for k point: 0.16415023803710938 Fixing h-field (band 1) phase by 1 + 7.27662e-16i; max ampl. = 1.27437 Fixing h-field (band 2) phase by -1 + -7.75672e-14i; max ampl. = 4.45322 Fixing h-field (band 3) phase by 1 + 2.58731e-13i; max ampl. = 2.62315 @@ -19766,7 +19793,7 @@ iteration 28: trace = 5.504362091981032 (5.83636e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14809679985046387 +elapsed time for k point: 0.18774199485778809 Fixing h-field (band 1) phase by 1 + -8.61367e-18i; max ampl. = 1.5052 Fixing h-field (band 2) phase by -1 + 2.17749e-14i; max ampl. = 3.59052 Fixing h-field (band 3) phase by -1 + -8.71241e-16i; max ampl. = 3.69829 @@ -19867,7 +19894,7 @@ iteration 44: trace = 5.538866868553973 (9.64849e-11% change) Finished solving for bands 1 to 8 after 44 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.2312910556793213 +elapsed time for k point: 0.2938547134399414 Fixing h-field (band 1) phase by 1 + -2.17709e-16i; max ampl. = 1.38878 Fixing h-field (band 2) phase by 1 + -9.39832e-16i; max ampl. = 3.48407 Fixing h-field (band 3) phase by 1 + 3.36734e-15i; max ampl. = 4.1103 @@ -19946,7 +19973,7 @@ iteration 33: trace = 5.419797732958386 (9.13285e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17615818977355957 +elapsed time for k point: 0.22167539596557617 Fixing h-field (band 1) phase by 1 + 9.26554e-17i; max ampl. = 1.39153 Fixing h-field (band 2) phase by -1 + 2.48815e-13i; max ampl. = 3.54504 Fixing h-field (band 3) phase by 1 + -3.24415e-13i; max ampl. = 3.95334 @@ -20015,7 +20042,7 @@ iteration 28: trace = 5.240853948733919 (3.68771e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14719128608703613 +elapsed time for k point: 0.19042301177978516 Fixing h-field (band 1) phase by 1 + 1.45418e-15i; max ampl. = 1.40192 Fixing h-field (band 2) phase by -1 + 1.63045e-12i; max ampl. = 3.73151 Fixing h-field (band 3) phase by 1 + -1.06411e-12i; max ampl. = 3.50756 @@ -20076,7 +20103,7 @@ iteration 24: trace = 5.096544273410628 (7.58252e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.1264493465423584 +elapsed time for k point: 0.1638948917388916 Fixing h-field (band 1) phase by -1 + 7.72062e-13i; max ampl. = 4.05119 Fixing h-field (band 2) phase by 1 + -1.00345e-15i; max ampl. = 1.42991 Fixing h-field (band 3) phase by -1 + -1.78409e-13i; max ampl. = 2.78416 @@ -20136,7 +20163,7 @@ iteration 23: trace = 5.006436496341387 (6.09039e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12161469459533691 +elapsed time for k point: 0.15673089027404785 Fixing h-field (band 1) phase by 1 + 3.42127e-16i; max ampl. = 4.46619 Fixing h-field (band 2) phase by 1 + 6.14564e-12i; max ampl. = 1.51506 Fixing h-field (band 3) phase by 1 + 2.28033e-15i; max ampl. = 1.66014 @@ -20196,7 +20223,7 @@ iteration 23: trace = 4.975984265381785 (5.45296e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12137055397033691 +elapsed time for k point: 0.1549394130706787 Fixing h-field (band 1) phase by 1 + 7.36552e-17i; max ampl. = 4.70977 Fixing h-field (band 2) phase by 1 + 4.17197e-14i; max ampl. = 1.38038 Fixing h-field (band 3) phase by -4.06954e-14 + 1i; max ampl. = 1.85505 @@ -20245,7 +20272,7 @@ iteration 18: trace = 5.036378479895267 (5.46869e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09593939781188965 +elapsed time for k point: 0.12484192848205566 Fixing h-field (band 1) phase by 1 + -7.70041e-17i; max ampl. = 3.59873 Fixing h-field (band 2) phase by 1 + 7.53608e-17i; max ampl. = 3.10702 Fixing h-field (band 3) phase by 3.40781e-10 + -1i; max ampl. = 1.92561 @@ -20300,7 +20327,7 @@ iteration 21: trace = 5.206566305891689 (3.92353e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11112689971923828 +elapsed time for k point: 0.14419078826904297 Fixing h-field (band 1) phase by 1 + -5.58261e-17i; max ampl. = 1.81199 Fixing h-field (band 2) phase by -1 + -2.34457e-16i; max ampl. = 4.51433 Fixing h-field (band 3) phase by -7.66503e-10 + 1i; max ampl. = 2.16532 @@ -20371,7 +20398,7 @@ iteration 29: trace = 5.417088766409226 (6.14025e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.1520531177520752 +elapsed time for k point: 0.19617676734924316 Fixing h-field (band 1) phase by 1 + 7.83277e-17i; max ampl. = 1.2604 Fixing h-field (band 2) phase by -1 + -6.80442e-15i; max ampl. = 4.86397 Fixing h-field (band 3) phase by -1.77698e-10 + 1i; max ampl. = 2.6696 @@ -20452,7 +20479,7 @@ iteration 34: trace = 5.522267645664738 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17858219146728516 +elapsed time for k point: 0.22965121269226074 Fixing h-field (band 1) phase by 1 + -2.24746e-16i; max ampl. = 1.05606 Fixing h-field (band 2) phase by -1 + -8.20455e-15i; max ampl. = 5.06002 Fixing h-field (band 3) phase by 6.41721e-11 + 1i; max ampl. = 3.59476 @@ -20655,7 +20682,7 @@ iteration 93: trace = 5.548117725325008 (3.72361e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.36521005630493164 +elapsed time for k point: 0.46315622329711914 Fixing h-field (band 1) phase by 1 + -0i; max ampl. = 1 Fixing h-field (band 2) phase by 1 + 1.25583e-14i; max ampl. = 5.12967 Fixing h-field (band 3) phase by 5.68529e-12 + -1i; max ampl. = 4.27896 @@ -20675,11 +20702,11 @@ Gap from band 2 (0.5931405141160888) to band 3 (0.5931535863117834), 0.0022038709776706538% Gap from band 4 (0.8096891551677092) to band 5 (0.824181444350217), 1.773982491243031% Gap from band 7 (1.0860729323594136) to band 8 (1.0878689635052707), 0.16523267243467563% -total elapsed time for run: 3.08490252494812 +total elapsed time for run: 3.8367910385131836 done -/tmp/meepWcFBDI/test_get_eigenvectors-0: 3.10s +/tmp/meephWM0hz/test_get_eigenvectors-0: 3.86s -/tmp/meepWcFBDI/test_get_hfield-0 +/tmp/meephWM0hz/test_get_hfield-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -20722,7 +20749,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002369403839111328 +elapsed time for initialization: 0.0031290054321289062 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -20833,7 +20860,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20675039291381836 +elapsed time for k point: 0.2700021266937256 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -21084,7 +21111,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.637631893157959 +elapsed time for k point: 0.8171951770782471 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21141,7 +21168,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13687634468078613 +elapsed time for k point: 0.17774319648742676 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21194,7 +21221,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.1265110969543457 +elapsed time for k point: 0.1640160083770752 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21255,7 +21282,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.1465892791748047 +elapsed time for k point: 0.18909263610839844 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21340,7 +21367,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.207780122756958 +elapsed time for k point: 0.26860928535461426 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -21411,7 +21438,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17255377769470215 +elapsed time for k point: 0.2370305061340332 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21472,7 +21499,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14679408073425293 +elapsed time for k point: 0.19484734535217285 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21525,7 +21552,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.1262965202331543 +elapsed time for k point: 0.16362905502319336 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21577,7 +21604,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.14064764976501465 +elapsed time for k point: 0.1641089916229248 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21629,7 +21656,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12096953392028809 +elapsed time for k point: 0.16531658172607422 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21670,7 +21697,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09575891494750977 +elapsed time for k point: 0.13485980033874512 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21717,7 +21744,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11145138740539551 +elapsed time for k point: 0.14828085899353027 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21780,7 +21807,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15199041366577148 +elapsed time for k point: 0.19952130317687988 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -21853,7 +21880,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17776870727539062 +elapsed time for k point: 0.2330319881439209 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -22048,7 +22075,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.35585832595825195 +elapsed time for k point: 0.478405237197876 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -22060,12 +22087,12 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.0656063556671143 +total elapsed time for run: 4.010080337524414 done Fixing h-field (band 8) phase by -1 + 2.59056e-07i; max ampl. = 4.48388 -./tmp/meepWcFBDI/test_get_hfield-0: 3.07s +./tmp/meephWM0hz/test_get_hfield-0: 7.37s -/tmp/meepWcFBDI/test_handle_cvector-0 +/tmp/meephWM0hz/test_handle_cvector-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -22108,7 +22135,7 @@ Vector3<-0.1333333333333333, 0.1333333333333333, 0.0> Vector3<-0.06666666666666665, 0.06666666666666665, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0026068687438964844 +elapsed time for initialization: 0.003663301467895508 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8 Solving for bands 2 to 8... @@ -22163,7 +22190,7 @@ iteration 24: trace = 4.577894626572786 (4.46816e-11% change) Finished solving for bands 2 to 8 after 24 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.560518, 0.560561, 0.593296, 0.837451, 0.837595, 0.994129, 1.09832 -elapsed time for k point: 0.0949258804321289 +elapsed time for k point: 0.1280515193939209 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -22204,7 +22231,7 @@ iteration 18: trace = 4.546667003404457 (4.24489e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tmfreqs:, 2, 0, 0.1, 0, 0.11547, 0.0711319, 0.538981, 0.559429, 0.617095, 0.834123, 0.839462, 0.988272, 1.08637 -elapsed time for k point: 0.0959014892578125 +elapsed time for k point: 0.12741756439208984 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -22239,7 +22266,7 @@ iteration 15: trace = 4.456771796562712 (4.07941e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 3, 0, 0.2, 0, 0.23094, 0.138898, 0.508574, 0.556587, 0.65398, 0.825087, 0.84452, 0.968999, 1.05281 -elapsed time for k point: 0.08054256439208984 +elapsed time for k point: 0.10804533958435059 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -22272,7 +22299,7 @@ iteration 14: trace = 4.364565233298257 (3.14404e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 4, 0, 0.3, 0, 0.34641, 0.198939, 0.479631, 0.553145, 0.693119, 0.813353, 0.850964, 0.932869, 1.02598 -elapsed time for k point: 0.07539606094360352 +elapsed time for k point: 0.09924817085266113 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -22303,7 +22330,7 @@ iteration 13: trace = 4.304069964437605 (7.18538e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 5, 0, 0.4, 0, 0.46188, 0.244064, 0.4557, 0.550414, 0.730028, 0.80289, 0.856372, 0.891379, 1.01409 -elapsed time for k point: 0.07028460502624512 +elapsed time for k point: 0.09241437911987305 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -22334,7 +22361,7 @@ iteration 13: trace = 4.283477065616431 (4.14492e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 6, 0, 0.5, 0, 0.57735, 0.262015, 0.445331, 0.549383, 0.749186, 0.797864, 0.85849, 0.870609, 1.01087 -elapsed time for k point: 0.0700383186340332 +elapsed time for k point: 0.09165430068969727 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -22363,7 +22390,7 @@ iteration 12: trace = 4.264474631199774 (8.73084e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 7, -0.0666667, 0.466667, 0, 0.581187, 0.262984, 0.4475, 0.545804, 0.752448, 0.797093, 0.860461, 0.870245, 0.99895 -elapsed time for k point: 0.0651857852935791 +elapsed time for k point: 0.08439159393310547 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -22392,7 +22419,7 @@ iteration 12: trace = 4.228595652264469 (8.17059e-12% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 8, -0.133333, 0.433333, 0, 0.592546, 0.265671, 0.453801, 0.535912, 0.761319, 0.795166, 0.866056, 0.869135, 0.973413 -elapsed time for k point: 0.0659637451171875 +elapsed time for k point: 0.0856013298034668 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -22417,7 +22444,7 @@ iteration 10: trace = 4.196577821229713 (9.14088e-11% change) Finished solving for bands 1 to 8 after 10 iterations. tmfreqs:, 9, -0.2, 0.4, 0, 0.61101, 0.269404, 0.463648, 0.52172, 0.773443, 0.792931, 0.867201, 0.874681, 0.94487 -elapsed time for k point: 0.05469799041748047 +elapsed time for k point: 0.07154488563537598 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -22442,7 +22469,7 @@ iteration 10: trace = 4.175651761333514 (5.29421e-11% change) Finished solving for bands 1 to 8 after 10 iterations. tmfreqs:, 10, -0.266667, 0.366667, 0, 0.635959, 0.273, 0.476141, 0.505606, 0.78524, 0.791235, 0.864672, 0.885801, 0.918597 -elapsed time for k point: 0.0550532341003418 +elapsed time for k point: 0.07445836067199707 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -22465,7 +22492,7 @@ iteration 9: trace = 4.168411689609144 (8.91074e-11% change) Finished solving for bands 1 to 8 after 9 iterations. tmfreqs:, 11, -0.333333, 0.333333, 0, 0.666667, 0.27469, 0.489984, 0.490239, 0.79072, 0.790832, 0.863041, 0.899109, 0.89925 -elapsed time for k point: 0.04969429969787598 +elapsed time for k point: 0.06376218795776367 Fixing e-field (band 1) phase by -1 + 4.11972e-08i; max ampl. = 0.93911 Fixing e-field (band 2) phase by -4.11972e-08 + -1i; max ampl. = 1.08316 Fixing e-field (band 3) phase by 1 + -4.11972e-08i; max ampl. = 0.877953 @@ -22500,7 +22527,7 @@ iteration 11: trace = 4.197854050309301 (1.33718e-11% change) Finished solving for bands 1 to 8 after 11 iterations. tmfreqs:, 12, -0.266667, 0.266667, 0, 0.533333, 0.2632, 0.47091, 0.51804, 0.764413, 0.795091, 0.864427, 0.896871, 0.932925 -elapsed time for k point: 0.0598750114440918 +elapsed time for k point: 0.07811689376831055 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -22529,7 +22556,7 @@ iteration 12: trace = 4.283266488990683 (1.11767e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 13, -0.2, 0.2, 0, 0.4, 0.222593, 0.476537, 0.539917, 0.715636, 0.806516, 0.856013, 0.929969, 0.977199 -elapsed time for k point: 0.06504297256469727 +elapsed time for k point: 0.08660531044006348 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -22560,7 +22587,7 @@ iteration 13: trace = 4.410102274545242 (2.51544e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 14, -0.133333, 0.133333, 0, 0.266667, 0.15856, 0.501245, 0.552927, 0.666818, 0.82116, 0.846938, 0.963589, 1.03113 -elapsed time for k point: 0.0700228214263916 +elapsed time for k point: 0.09313082695007324 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -22599,7 +22626,7 @@ iteration 17: trace = 4.534517622757207 (7.8407e-11% change) Finished solving for bands 1 to 8 after 17 iterations. tmfreqs:, 15, -0.0666667, 0.0666667, 0, 0.133333, 0.0819275, 0.534465, 0.558896, 0.622523, 0.832982, 0.840137, 0.98638, 1.08149 -elapsed time for k point: 0.09096097946166992 +elapsed time for k point: 0.12600016593933105 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 4 iterations. @@ -22636,7 +22663,7 @@ iteration 16: trace = 4.577894626572483 (2.55905e-11% change) Finished solving for bands 2 to 8 after 16 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.560518, 0.560561, 0.593296, 0.837451, 0.837595, 0.994129, 1.09832 -elapsed time for k point: 0.06360220909118652 +elapsed time for k point: 0.0903010368347168 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.2746902258623629 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> Band 2 range: 0.44533108084715833 at Vector3<0.0, 0.5, 0.0> to 0.5605181423162844 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.49023891490276683 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> to 0.5605607947797752 at Vector3<0.0, 0.0, 0.0> @@ -22650,7 +22677,7 @@ Gap from band 4 (0.79071959744437) to band 5 (0.7908320763327578), 0.014223865113315824% Gap from band 5 (0.8374511167537574) to band 6 (0.8375948528443272), 0.017162047272568082% Gap from band 6 (0.8672009264903449) to band 7 (0.8691349955739198), 0.2227759109280675% -total elapsed time for run: 1.1327757835388184 +total elapsed time for run: 1.5083277225494385 done Read lattice vectors Read Bloch wavevector (-0.333333, 0.333333, 0) @@ -22668,9 +22695,9 @@ imag part range: -6.6866e-33 .. 6.6866e-33 real part range: -1.03932 .. 1.03493 imag part range: -1.08496 .. 1.08496 -./tmp/meepWcFBDI/test_handle_cvector-0: 1.16s +./tmp/meephWM0hz/test_handle_cvector-0: 6.59s -/tmp/meepWcFBDI/test_hermitian_eps-0 +/tmp/meephWM0hz/test_hermitian_eps-0 ======================== Initializing eigensolver data Computing 10 bands with 1e-12 tolerance @@ -22708,7 +22735,7 @@ Vector3<0.33333333333333337, 0.33333333333333337, 0.0> Vector3<0.16666666666666669, 0.16666666666666669, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0024225711822509766 +elapsed time for initialization: 0.003143787384033203 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8, tm band 9, tm band 10 Solving for bands 2 to 10... @@ -26320,7 +26347,7 @@ iteration 1600: trace = 2.393039433614877 (7.2727e-11% change) Finished solving for bands 2 to 10 after 1600 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.265885, 0.356852, 0.36899, 0.503897, 0.506552, 0.539911, 0.635681, 0.645852, 0.660016 -elapsed time for k point: 15.16594386100769 +elapsed time for k point: 17.997116804122925 solve_kpoint (0.166667,0,0): Solving for bands 1 to 10... linmin: converged after 5 iterations. @@ -29854,7 +29881,7 @@ iteration 1567: trace = 2.412629747151596 (8.61073e-11% change) Finished solving for bands 1 to 10 after 1567 iterations. tmfreqs:, 2, 0.166667, 0, 0, 0.166667, 0.123306, 0.278292, 0.357366, 0.369461, 0.503797, 0.506642, 0.538217, 0.63557, 0.645595, 0.659431 -elapsed time for k point: 17.225045919418335 +elapsed time for k point: 18.142792224884033 solve_kpoint (0.333333,0,0): Solving for bands 1 to 10... linmin: converged after 4 iterations. @@ -32836,7 +32863,7 @@ iteration 1331: trace = 2.451789423896146 (9.19952e-11% change) Finished solving for bands 1 to 10 after 1331 iterations. tmfreqs:, 3, 0.333333, 0, 0, 0.333333, 0.194655, 0.331458, 0.361679, 0.377947, 0.502693, 0.506755, 0.527227, 0.633335, 0.644215, 0.653287 -elapsed time for k point: 14.883981704711914 +elapsed time for k point: 15.25282907485962 solve_kpoint (0.5,0,0): Solving for bands 1 to 10... linmin: converged after 4 iterations. @@ -35917,7 +35944,7 @@ iteration 1371: trace = 2.449292757192449 (6.94611e-11% change) Finished solving for bands 1 to 10 after 1371 iterations. tmfreqs:, 4, 0.5, 0, 0, 0.5, 0.208799, 0.348978, 0.365278, 0.443856, 0.477901, 0.506845, 0.509076, 0.617527, 0.63971, 0.64689 -elapsed time for k point: 15.30261778831482 +elapsed time for k point: 17.721961736679077 solve_kpoint (0.5,0.166667,0): Solving for bands 1 to 10... linmin: converged after 4 iterations. @@ -38273,7 +38300,7 @@ iteration 1047: trace = 2.485865194972738 (7.34055e-11% change) Finished solving for bands 1 to 10 after 1047 iterations. tmfreqs:, 5, 0.5, 0.166667, 0, 0.527046, 0.210673, 0.351103, 0.364915, 0.453355, 0.500502, 0.507018, 0.510125, 0.616821, 0.642478, 0.646894 -elapsed time for k point: 11.55051565170288 +elapsed time for k point: 12.608862161636353 solve_kpoint (0.5,0.333333,0): Solving for bands 1 to 10... linmin: converged after 5 iterations. @@ -39840,7 +39867,7 @@ iteration 695: trace = 2.578881665331004 (9.27137e-11% change) Finished solving for bands 1 to 10 after 695 iterations. tmfreqs:, 6, 0.5, 0.333333, 0, 0.600925, 0.214081, 0.353217, 0.365001, 0.471977, 0.507165, 0.51079, 0.563894, 0.615052, 0.646178, 0.648357 -elapsed time for k point: 7.919523000717163 +elapsed time for k point: 8.391424894332886 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 10... linmin: converged after 5 iterations. @@ -40985,7 +41012,7 @@ iteration 504: trace = 2.65386095688817 (8.29657e-11% change) Finished solving for bands 1 to 10 after 504 iterations. tmfreqs:, 7, 0.5, 0.5, 0, 0.707107, 0.215649, 0.353602, 0.365269, 0.480748, 0.507335, 0.512534, 0.60792, 0.619784, 0.648908, 0.650323 -elapsed time for k point: 5.601140975952148 +elapsed time for k point: 5.466943740844727 solve_kpoint (0.333333,0.333333,0): Solving for bands 1 to 10... linmin: converged after 6 iterations. @@ -42428,7 +42455,7 @@ iteration 635: trace = 2.532226604459286 (6.79403e-11% change) Finished solving for bands 1 to 10 after 635 iterations. tmfreqs:, 8, 0.333333, 0.333333, 0, 0.471405, 0.210879, 0.35463, 0.361245, 0.439486, 0.507022, 0.508252, 0.543815, 0.620599, 0.646589, 0.651154 -elapsed time for k point: 7.016152858734131 +elapsed time for k point: 6.912139892578125 solve_kpoint (0.166667,0.166667,0): Solving for bands 1 to 10... linmin: converged after 5 iterations. @@ -44378,7 +44405,7 @@ iteration 863: trace = 2.429159854402552 (6.97626e-11% change) Finished solving for bands 1 to 10 after 863 iterations. tmfreqs:, 9, 0.166667, 0.166667, 0, 0.235702, 0.162353, 0.295874, 0.356214, 0.372161, 0.504258, 0.506735, 0.537355, 0.633231, 0.645916, 0.65717 -elapsed time for k point: 9.374943256378174 +elapsed time for k point: 10.848774433135986 solve_kpoint (0,0,0): Solving for bands 2 to 10... linmin: converged after 4 iterations. @@ -45848,7 +45875,7 @@ iteration 654: trace = 2.393039431891898 (8.4177e-11% change) Finished solving for bands 2 to 10 after 654 iterations. tmfreqs:, 10, 0, 0, 0, 0, 0, 0.265885, 0.356852, 0.36899, 0.503897, 0.506552, 0.539911, 0.635681, 0.645852, 0.660016 -.elapsed time for k point: 6.203810453414917 +.elapsed time for k point: 6.404205083847046 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.2156485263004528 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.26588497856536614 at Vector3<0.0, 0.0, 0.0> to 0.35463024054636866 at Vector3<0.33333333333333337, 0.33333333333333337, 0.0> Band 3 range: 0.3562142355908947 at Vector3<0.16666666666666669, 0.16666666666666669, 0.0> to 0.36527833517582053 at Vector3<0.5, 0.0, 0.0> @@ -45864,11 +45891,11 @@ Gap from band 3 (0.36527833517582053) to band 4 (0.3689901366659233), 1.0110202555184071% Gap from band 7 (0.6079200818073007) to band 8 (0.6150518764852911), 1.16630551168928% Gap from band 8 (0.635680784601736) to band 9 (0.6397097609333313), 0.6318027596644891% -total elapsed time for run: 110.24687004089355 +total elapsed time for run: 119.75098037719727 done -/tmp/meepWcFBDI/test_hermitian_eps-0: 110.25s +/tmp/meephWM0hz/test_hermitian_eps-0: 119.75s -/tmp/meepWcFBDI/test_hole_slab-0 +/tmp/meephWM0hz/test_hole_slab-0 ======================== Initializing eigensolver data Computing 9 bands with 1e-12 tolerance @@ -45902,7 +45929,7 @@ Initializing fields to random numbers... 1 k-points Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> -elapsed time for initialization: 0.17631769180297852 +elapsed time for initialization: 0.24667644500732422 solve_kpoint (-0.333333,0.333333,0): zevenfreqs:, k index, k1, k2, k3, kmag/2pi, zeven band 1, zeven band 2, zeven band 3, zeven band 4, zeven band 5, zeven band 6, zeven band 7, zeven band 8, zeven band 9 Solving for bands 1 to 9... @@ -45971,17 +45998,17 @@ iteration 31: trace = 2.187958069704349 (9.36705e-11% change) Finished solving for bands 1 to 9 after 31 iterations. zevenfreqs:, 1, -0.333333, 0.333333, 0, 0.666667, 0.265718, 0.356033, 0.35608, 0.513443, 0.529044, 0.529286, 0.586884, 0.587044, 0.59253 -elapsed time for k point: 15.07497239112854 -total elapsed time for run: 15.25137710571289 +elapsed time for k point: 17.13029408454895 +total elapsed time for run: 17.37706160545349 done Fixing h-field (band 9) phase by 0.0246538 + 0.999696i; max ampl. = 2.37913 -FOutputting fields to /tmp/meepWcFBDI/test_hole_slab-0-h.k01.b09.z.zeven.h5... +FOutputting fields to /tmp/meephWM0hz/test_hole_slab-0-h.k01.b09.z.zeven.h5... eigensolver iterations for 1 kpoints: 31.0-31.0, mean = 31.0, median = 31.0 mean flops per iteration = 232048195.5483871 -mean time per iteration = 0.4919799066358997 s -/tmp/meepWcFBDI/test_hole_slab-0: 15.28s +mean time per iteration = 0.5605503743694674 s +/tmp/meephWM0hz/test_hole_slab-0: 17.40s -/tmp/meepWcFBDI/test_honey_rods-0 +/tmp/meephWM0hz/test_honey_rods-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -46026,7 +46053,7 @@ Vector3<-0.1333333333333333, 0.1333333333333333, 0.0> Vector3<-0.06666666666666665, 0.06666666666666665, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002752065658569336 +elapsed time for initialization: 0.003646373748779297 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8 Solving for bands 2 to 8... @@ -46112,7 +46139,7 @@ iteration 38: trace = 4.38487035911433 (2.56637e-11% change) Finished solving for bands 2 to 8 after 38 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.429848, 0.72559, 0.725871, 0.769398, 0.785279, 0.785658, 1.14928 -elapsed time for k point: 0.1496884822845459 +elapsed time for k point: 0.18941307067871094 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... linmin: converged after 7 iterations. @@ -46186,7 +46213,7 @@ iteration 34: trace = 4.363900038828967 (4.24154e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tmfreqs:, 2, 0, 0.1, 0, 0.11547, 0.0718091, 0.426256, 0.719077, 0.721195, 0.746706, 0.789405, 0.817423, 1.1362 -elapsed time for k point: 0.18567490577697754 +elapsed time for k point: 0.2271709442138672 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -46225,7 +46252,7 @@ iteration 17: trace = 4.325994457593166 (2.5356e-11% change) Finished solving for bands 1 to 8 after 17 iterations. tmfreqs:, 3, 0, 0.2, 0, 0.23094, 0.141741, 0.415465, 0.686677, 0.711385, 0.749716, 0.79757, 0.853936, 1.10829 -elapsed time for k point: 0.09116244316101074 +elapsed time for k point: 0.11582279205322266 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -46262,7 +46289,7 @@ iteration 16: trace = 4.298080976434066 (6.69531e-12% change) Finished solving for bands 1 to 8 after 16 iterations. tmfreqs:, 4, 0, 0.3, 0, 0.34641, 0.20751, 0.397084, 0.652562, 0.701411, 0.762486, 0.805503, 0.884623, 1.08016 -elapsed time for k point: 0.08597993850708008 +elapsed time for k point: 0.10679411888122559 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -46297,7 +46324,7 @@ iteration 15: trace = 4.286087121421346 (1.84429e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 5, 0, 0.4, 0, 0.46188, 0.265341, 0.370741, 0.628064, 0.694375, 0.774438, 0.810881, 0.90516, 1.06067 -elapsed time for k point: 0.08241009712219238 +elapsed time for k point: 0.10088300704956055 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -46328,7 +46355,7 @@ iteration 13: trace = 4.283886820302828 (6.60761e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 6, 0, 0.5, 0, 0.57735, 0.29861, 0.348622, 0.619112, 0.691863, 0.779379, 0.812758, 0.912256, 1.05404 -elapsed time for k point: 0.07213115692138672 +elapsed time for k point: 0.08767223358154297 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -46357,7 +46384,7 @@ iteration 12: trace = 4.287889499871685 (9.82241e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 7, -0.0666667, 0.466667, 0, 0.581187, 0.300268, 0.34895, 0.613584, 0.697444, 0.77731, 0.813624, 0.911843, 1.05612 -elapsed time for k point: 0.06656050682067871 +elapsed time for k point: 0.08137822151184082 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -46390,7 +46417,7 @@ iteration 14: trace = 4.299904770939231 (1.58636e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 8, -0.133333, 0.433333, 0, 0.592546, 0.305133, 0.349455, 0.601266, 0.710158, 0.771875, 0.815569, 0.910763, 1.06226 -elapsed time for k point: 0.07659721374511719 +elapsed time for k point: 0.09548330307006836 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -46423,7 +46450,7 @@ iteration 14: trace = 4.319879224622893 (9.40221e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 9, -0.2, 0.4, 0, 0.61101, 0.312896, 0.348732, 0.588291, 0.724572, 0.764453, 0.817539, 0.909459, 1.0721 -elapsed time for k point: 0.07560586929321289 +elapsed time for k point: 0.09384012222290039 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -46460,7 +46487,7 @@ iteration 16: trace = 4.347482286295501 (4.98485e-12% change) Finished solving for bands 1 to 8 after 16 iterations. tmfreqs:, 10, -0.266667, 0.366667, 0, 0.635959, 0.323089, 0.344682, 0.578717, 0.737675, 0.756131, 0.818898, 0.9085, 1.08513 -elapsed time for k point: 0.08584260940551758 +elapsed time for k point: 0.20425868034362793 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -46525,7 +46552,7 @@ iteration 28: trace = 4.381215657475532 (1.29946e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tmfreqs:, 11, -0.333333, 0.333333, 0, 0.666667, 0.335117, 0.335185, 0.575171, 0.747622, 0.747877, 0.819365, 0.908267, 1.10053 -elapsed time for k point: 0.14951324462890625 +elapsed time for k point: 0.20404434204101562 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -46560,7 +46587,7 @@ iteration 15: trace = 4.322737319376869 (1.86358e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 12, -0.266667, 0.266667, 0, 0.533333, 0.29626, 0.362261, 0.589196, 0.732899, 0.756464, 0.817346, 0.906977, 1.07543 -elapsed time for k point: 0.08029389381408691 +elapsed time for k point: 0.10760951042175293 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -46591,7 +46618,7 @@ iteration 13: trace = 4.300851491405954 (5.98885e-12% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 13, -0.2, 0.2, 0, 0.4, 0.235812, 0.389044, 0.624419, 0.723246, 0.753158, 0.811064, 0.894195, 1.07529 -elapsed time for k point: 0.07018876075744629 +elapsed time for k point: 0.09655022621154785 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -46622,7 +46649,7 @@ iteration 13: trace = 4.317112896788797 (5.00963e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 14, -0.133333, 0.133333, 0, 0.266667, 0.162664, 0.41101, 0.66948, 0.720558, 0.745707, 0.801251, 0.86394, 1.09993 -elapsed time for k point: 0.07019615173339844 +elapsed time for k point: 0.09983372688293457 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -46659,7 +46686,7 @@ iteration 16: trace = 4.35829751621239 (8.24331e-11% change) Finished solving for bands 1 to 8 after 16 iterations. tmfreqs:, 15, -0.0666667, 0.0666667, 0, 0.133333, 0.0828005, 0.425068, 0.71283, 0.723369, 0.744337, 0.790724, 0.823156, 1.13248 -elapsed time for k point: 0.08565759658813477 +elapsed time for k point: 0.11650419235229492 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -46860,7 +46887,7 @@ iteration 93: trace = 4.384870359106209 (1.56778e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.429848, 0.72559, 0.725871, 0.769398, 0.785279, 0.785658, 1.14928 -elapsed time for k point: 0.3662266731262207 +elapsed time for k point: 0.4725806713104248 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.33511676603549895 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> Band 2 range: 0.3351850759916977 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> to 0.4298481123781638 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.5751709345431465 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> to 0.7255897672261694 at Vector3<0.0, 0.0, 0.0> @@ -46873,7 +46900,7 @@ Gap from band 2 (0.4298481123781638) to band 3 (0.5751709345431465), 28.919416524523044% Gap from band 5 (0.7793792212092521) to band 6 (0.7852786984418483), 0.7540916335133137% Gap from band 7 (0.9122560439014175) to band 8 (1.054035050813511), 14.420958045649755% -total elapsed time for run: 1.7974586486816406 +total elapsed time for run: 2.4047107696533203 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -46917,7 +46944,7 @@ Vector3<-0.1333333333333333, 0.1333333333333333, 0.0> Vector3<-0.06666666666666665, 0.06666666666666665, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002801656723022461 +elapsed time for initialization: 0.0038938522338867188 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -47119,7 +47146,7 @@ iteration 91: trace = 6.466405545431808 (3.67556e-11% change) Finished solving for bands 2 to 8 after 91 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.727845, 0.788088, 0.920961, 0.922085, 1.01687, 1.01845, 1.24334 -elapsed time for k point: 0.3553128242492676 +elapsed time for k point: 0.4546074867248535 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -47224,7 +47251,7 @@ iteration 50: trace = 6.367909049127854 (9.13018e-11% change) Finished solving for bands 1 to 8 after 50 iterations. tefreqs:, 2, 0, 0.1, 0, 0.11547, 0.10214, 0.723854, 0.784332, 0.900771, 0.902155, 1.03144, 1.03948, 1.2036 -elapsed time for k point: 0.3841729164123535 +elapsed time for k point: 0.33666539192199707 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... linmin: converged after 14 iterations. @@ -47281,7 +47308,7 @@ iteration 26: trace = 6.307408527722557 (7.9293e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0, 0.2, 0, 0.23094, 0.203735, 0.707761, 0.769484, 0.867508, 0.869257, 1.05383, 1.07964, 1.17834 -elapsed time for k point: 0.13823866844177246 +elapsed time for k point: 0.18405985832214355 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -47338,7 +47365,7 @@ iteration 26: trace = 6.281971560075131 (8.24559e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 4, 0, 0.3, 0, 0.34641, 0.304067, 0.663675, 0.75048, 0.840899, 0.85049, 1.07273, 1.11526, 1.16655 -elapsed time for k point: 0.13792800903320312 +elapsed time for k point: 0.17803049087524414 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -47405,7 +47432,7 @@ iteration 31: trace = 6.282671766119803 (5.95873e-11% change) Finished solving for bands 1 to 8 after 31 iterations. tefreqs:, 5, 0, 0.4, 0, 0.46188, 0.401691, 0.590457, 0.741009, 0.822518, 0.84569, 1.08497, 1.13738, 1.16665 -elapsed time for k point: 0.16335391998291016 +elapsed time for k point: 0.20916986465454102 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -47488,7 +47515,7 @@ iteration 39: trace = 6.29440570326861 (7.75095e-11% change) Finished solving for bands 1 to 8 after 39 iterations. tefreqs:, 6, 0, 0.5, 0, 0.57735, 0.478396, 0.520318, 0.738393, 0.816173, 0.844859, 1.08909, 1.14451, 1.17202 -elapsed time for k point: 0.20454835891723633 +elapsed time for k point: 0.2622873783111572 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -47553,7 +47580,7 @@ iteration 30: trace = 6.296467689265774 (7.75265e-11% change) Finished solving for bands 1 to 8 after 30 iterations. tefreqs:, 7, -0.0666667, 0.466667, 0, 0.581187, 0.48205, 0.522761, 0.727295, 0.819868, 0.844497, 1.09131, 1.14544, 1.17197 -elapsed time for k point: 0.1574413776397705 +elapsed time for k point: 0.20371103286743164 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -47624,7 +47651,7 @@ iteration 33: trace = 6.301845550822886 (4.1112e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 8, -0.133333, 0.433333, 0, 0.592546, 0.492796, 0.529981, 0.69937, 0.826669, 0.843482, 1.09673, 1.14811, 1.17183 -elapsed time for k point: 0.17322111129760742 +elapsed time for k point: 0.2274792194366455 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -47697,7 +47724,7 @@ iteration 34: trace = 6.309184046353366 (7.89047e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 9, -0.2, 0.4, 0, 0.61101, 0.510012, 0.541662, 0.661523, 0.832379, 0.841947, 1.10264, 1.15222, 1.1717 -elapsed time for k point: 0.1778411865234375 +elapsed time for k point: 0.23207640647888184 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -47772,7 +47799,7 @@ iteration 35: trace = 6.318322876593968 (6.70106e-11% change) Finished solving for bands 1 to 8 after 35 iterations. tefreqs:, 10, -0.266667, 0.366667, 0, 0.635959, 0.532564, 0.557306, 0.617759, 0.836201, 0.840118, 1.10684, 1.15685, 1.1722 -elapsed time for k point: 0.18238282203674316 +elapsed time for k point: 0.24007248878479004 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -47929,7 +47956,7 @@ iteration 72: trace = 6.329316110445949 (8.96413e-11% change) Finished solving for bands 1 to 8 after 72 iterations. tefreqs:, 11, -0.333333, 0.333333, 0, 0.666667, 0.553509, 0.57602, 0.576336, 0.838242, 0.838556, 1.10835, 1.15937, 1.17498 -elapsed time for k point: 0.3736143112182617 +elapsed time for k point: 0.4444289207458496 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -48140,7 +48167,7 @@ iteration 101: trace = 6.298594861654117 (6.21864e-11% change) Finished solving for bands 1 to 8 after 101 iterations. tefreqs:, 12, -0.266667, 0.266667, 0, 0.533333, 0.461593, 0.620594, 0.628556, 0.836746, 0.840202, 1.10228, 1.15102, 1.16591 -elapsed time for k point: 0.5236377716064453 +elapsed time for k point: 0.517848014831543 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -48195,7 +48222,7 @@ iteration 25: trace = 6.282608553113039 (8.71128e-11% change) Finished solving for bands 1 to 8 after 25 iterations. tefreqs:, 13, -0.2, 0.2, 0, 0.4, 0.350141, 0.666671, 0.698454, 0.841979, 0.843343, 1.08599, 1.12874, 1.16367 -elapsed time for k point: 0.13265371322631836 +elapsed time for k point: 0.1310255527496338 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -48248,7 +48275,7 @@ iteration 24: trace = 6.296830790289762 (6.42631e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 14, -0.133333, 0.133333, 0, 0.266667, 0.234979, 0.703081, 0.756416, 0.858378, 0.861716, 1.0625, 1.09087, 1.1734 -elapsed time for k point: 0.12745451927185059 +elapsed time for k point: 0.12489509582519531 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -48305,7 +48332,7 @@ iteration 26: trace = 6.356049883130341 (5.77535e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 15, -0.0666667, 0.0666667, 0, 0.133333, 0.117907, 0.722467, 0.782825, 0.895483, 0.896999, 1.03533, 1.04486, 1.19885 -elapsed time for k point: 0.13933062553405762 +elapsed time for k point: 0.23903846740722656 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 4 iterations. @@ -48454,7 +48481,7 @@ iteration 67: trace = 6.466405545350961 (9.26307e-11% change) Finished solving for bands 2 to 8 after 67 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.727845, 0.788088, 0.920961, 0.922085, 1.01687, 1.01845, 1.24334 -.elapsed time for k point: 0.2574446201324463 +.elapsed time for k point: 0.39305567741394043 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.5535093489972592 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> Band 2 range: 0.5203183590840945 at Vector3<0.0, 0.5, 0.0> to 0.7278447515454931 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.5763358596513122 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> to 0.7880878930618368 at Vector3<0.0, 0.0, 0.0> @@ -48466,11 +48493,11 @@ Gap from band 3 (0.7880878930618368) to band 4 (0.816173029367493), 3.5013177610942434% Gap from band 5 (0.9220849425898026) to band 6 (1.0168656683915518), 9.776497169649742% Gap from band 7 (1.1593702273707203) to band 8 (1.1636719050364366), 0.3703486566779469% -total elapsed time for run: 3.632388114929199 +total elapsed time for run: 4.383531332015991 done -/tmp/meepWcFBDI/test_honey_rods-0: 5.43s +/tmp/meephWM0hz/test_honey_rods-0: 6.79s -/tmp/meepWcFBDI/test_line_defect-0 +/tmp/meephWM0hz/test_line_defect-0 ======================== Initializing eigensolver data Computing 12 bands with 1e-12 tolerance @@ -48517,7 +48544,7 @@ Vector3<0.3, 1.0499999999999998, 0.0> Vector3<0.39999999999999997, 1.4, 0.0> Vector3<0.49999999999999994, 1.75, 0.0> -elapsed time for initialization: 0.018489599227905273 +elapsed time for initialization: 0.02375054359436035 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8, tm band 9, tm band 10, tm band 11, tm band 12 Solving for bands 2 to 7... @@ -48714,7 +48741,7 @@ Finished solving for bands 8 to 12 after 76 iterations. Finished k-point with 39.6667 mean iterations/band. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.100888, 0.110544, 0.191438, 0.209077, 0.252769, 0.337337, 0.453613, 0.461172, 0.496485, 0.499488, 0.545123 -elapsed time for k point: 2.3587920665740967 +elapsed time for k point: 2.8766279220581055 Fixing e-field (band 1) phase by 1 + -0i; max ampl. = 0 Fixing e-field (band 2) phase by 0.934778 + -0.355231i; max ampl. = 0.36443 Fixing e-field (band 3) phase by 0.41377 + -0.910381i; max ampl. = 0.363694 @@ -48727,18 +48754,18 @@ Fixing e-field (band 10) phase by 0.833535 + -0.552467i; max ampl. = 0.514872 Fixing e-field (band 11) phase by 0.701379 + -0.712788i; max ampl. = 0.525048 Fixing e-field (band 12) phase by -0.711256 + 0.702933i; max ampl. = 0.596428 -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b01.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b02.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b03.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b04.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b05.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b06.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b07.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b08.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b09.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b10.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b11.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k01.b12.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b01.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b02.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b03.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b04.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b05.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b06.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b07.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b08.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b09.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b10.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b11.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k01.b12.z.tm.h5... solve_kpoint (0.1,0.35,0): Solving for bands 1 to 6... linmin: converged after 6 iterations. @@ -48836,7 +48863,7 @@ Finished solving for bands 7 to 12 after 37 iterations. Finished k-point with 22.5 mean iterations/band. tmfreqs:, 2, 0.1, 0.35, 0, 0.1, 0.0643286, 0.117273, 0.128193, 0.198551, 0.216266, 0.255606, 0.34632, 0.457251, 0.464418, 0.494572, 0.497876, 0.533413 -elapsed time for k point: 1.4262311458587646 +elapsed time for k point: 1.8496239185333252 Fixing e-field (band 1) phase by -1 + 2.71685e-09i; max ampl. = 0.279221 Fixing e-field (band 2) phase by 0.0662327 + 0.997804i; max ampl. = 0.368961 Fixing e-field (band 3) phase by 1 + -3.08277e-07i; max ampl. = 0.357513 @@ -48849,18 +48876,18 @@ Fixing e-field (band 10) phase by 1 + 8.06441e-05i; max ampl. = 0.50134 Fixing e-field (band 11) phase by 2.03319e-05 + 1i; max ampl. = 0.518018 Fixing e-field (band 12) phase by -0.000314791 + -1i; max ampl. = 0.377816 -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b01.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b02.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b03.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b04.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b05.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b06.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b07.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b08.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b09.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b10.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b11.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k02.b12.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b01.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b02.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b03.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b04.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b05.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b06.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b07.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b08.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b09.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b10.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b11.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k02.b12.z.tm.h5... solve_kpoint (0.2,0.7,0): Solving for bands 1 to 6... linmin: converged after 5 iterations. @@ -48950,7 +48977,7 @@ Finished solving for bands 7 to 12 after 32 iterations. Finished k-point with 20 mean iterations/band. tmfreqs:, 3, 0.2, 0.7, 0, 0.2, 0.12511, 0.154647, 0.167476, 0.216994, 0.234024, 0.262757, 0.372785, 0.466507, 0.471319, 0.486474, 0.490761, 0.511423 -elapsed time for k point: 1.2993664741516113 +elapsed time for k point: 1.7226283550262451 Fixing e-field (band 1) phase by 1 + -6.73909e-16i; max ampl. = 0.316626 Fixing e-field (band 2) phase by 1.18012e-10 + 1i; max ampl. = 0.383063 Fixing e-field (band 3) phase by 1 + -1.02081e-14i; max ampl. = 0.3761 @@ -48963,18 +48990,18 @@ Fixing e-field (band 10) phase by -1 + 3.83177e-10i; max ampl. = 0.454743 Fixing e-field (band 11) phase by 4.76626e-08 + 1i; max ampl. = 0.493615 Fixing e-field (band 12) phase by -1.94517e-06 + -1i; max ampl. = 0.473136 -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b01.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b02.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b03.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b04.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b05.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b06.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b07.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b08.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b09.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b10.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b11.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k03.b12.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b01.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b02.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b03.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b04.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b05.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b06.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b07.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b08.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b09.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b10.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b11.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k03.b12.z.tm.h5... solve_kpoint (0.3,1.05,0): Solving for bands 1 to 6... linmin: converged after 5 iterations. @@ -49196,7 +49223,7 @@ Finished solving for bands 7 to 12 after 95 iterations. Finished k-point with 51.5 mean iterations/band. tmfreqs:, 4, 0.3, 1.05, 0, 0.3, 0.179731, 0.197126, 0.209614, 0.239781, 0.253491, 0.270127, 0.412201, 0.46839, 0.470281, 0.47669, 0.478853, 0.489567 -elapsed time for k point: 3.3986871242523193 +elapsed time for k point: 4.512251377105713 Fixing e-field (band 1) phase by 1 + -4.6229e-17i; max ampl. = 0.362092 Fixing e-field (band 2) phase by 3.66735e-12 + 1i; max ampl. = 0.407764 Fixing e-field (band 3) phase by 1 + 4.17696e-16i; max ampl. = 0.420136 @@ -49209,18 +49236,18 @@ Fixing e-field (band 10) phase by 1 + -4.03304e-13i; max ampl. = 0.483552 Fixing e-field (band 11) phase by -1.20957e-10 + 1i; max ampl. = 0.523494 Fixing e-field (band 12) phase by -1 + -7.30084e-11i; max ampl. = 0.423458 -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b01.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b02.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b03.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b04.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b05.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b06.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b07.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b08.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b09.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b10.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b11.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k04.b12.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b01.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b02.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b03.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b04.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b05.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b06.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b07.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b08.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b09.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b10.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b11.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k04.b12.z.tm.h5... solve_kpoint (0.4,1.4,0): Solving for bands 1 to 6... linmin: converged after 5 iterations. @@ -49382,7 +49409,7 @@ Finished solving for bands 7 to 12 after 67 iterations. Finished k-point with 38 mean iterations/band. tmfreqs:, 5, 0.4, 1.4, 0, 0.4, 0.225148, 0.234786, 0.243351, 0.257936, 0.264707, 0.270821, 0.441523, 0.454532, 0.455044, 0.464121, 0.471551, 0.472447 -elapsed time for k point: 2.450840711593628 +elapsed time for k point: 2.6881465911865234 Fixing e-field (band 1) phase by 1 + -5.70545e-17i; max ampl. = 0.407996 Fixing e-field (band 2) phase by -3.78215e-12 + 1i; max ampl. = 0.441101 Fixing e-field (band 3) phase by -1 + -1.25589e-15i; max ampl. = 0.464954 @@ -49395,18 +49422,18 @@ Fixing e-field (band 10) phase by -1.20409e-13 + 1i; max ampl. = 0.518507 Fixing e-field (band 11) phase by -1 + 1.90851e-12i; max ampl. = 0.471405 Fixing e-field (band 12) phase by -3.22577e-14 + 1i; max ampl. = 0.443866 -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b01.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b02.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b03.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b04.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b05.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b06.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b07.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b08.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b09.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b10.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b11.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k05.b12.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b01.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b02.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b03.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b04.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b05.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b06.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b07.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b08.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b09.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b10.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b11.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k05.b12.z.tm.h5... solve_kpoint (0.5,1.75,0): Solving for bands 1 to 6... linmin: converged after 5 iterations. @@ -49462,7 +49489,7 @@ Finished solving for bands 7 to 12 after 15 iterations. Finished k-point with 12 mean iterations/band. tmfreqs:, 6, 0.5, 1.75, 0, 0.5, 0.25635, 0.256978, 0.258342, 0.259571, 0.260868, 0.261719, 0.442498, 0.448263, 0.451495, 0.456403, 0.462907, 0.46569 -elapsed time for k point: 0.7566602230072021 +elapsed time for k point: 0.9854490756988525 Fixing e-field (band 1) phase by 1 + -5.03646e-17i; max ampl. = 0.422882 Fixing e-field (band 2) phase by 2.80271e-12 + -1i; max ampl. = 0.466091 Fixing e-field (band 3) phase by -1 + -2.5993e-16i; max ampl. = 0.462198 @@ -49475,18 +49502,18 @@ Fixing e-field (band 10) phase by 8.81578e-13 + 1i; max ampl. = 0.472551 Fixing e-field (band 11) phase by 1 + -2.00359e-14i; max ampl. = 0.507635 Fixing e-field (band 12) phase by -1.13227e-12 + 1i; max ampl. = 0.465525 -..Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b01.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b02.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b03.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b04.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b05.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b06.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b07.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b08.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b09.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b10.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b11.z.tm.h5... -Outputting fields to /tmp/meepWcFBDI/test_line_defect-0-e.k06.b12.z.tm.h5... +..Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b01.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b02.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b03.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b04.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b05.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b06.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b07.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b08.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b09.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b10.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b11.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_line_defect-0-e.k06.b12.z.tm.h5... Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.25635010535444464 at Vector3<0.49999999999999994, 1.75, 0.0> Band 2 range: 0.10088801014542138 at Vector3<0.0, 0.0, 0.0> to 0.25697767129278265 at Vector3<0.49999999999999994, 1.75, 0.0> Band 3 range: 0.11054374616923922 at Vector3<0.0, 0.0, 0.0> to 0.25834187991797386 at Vector3<0.49999999999999994, 1.75, 0.0> @@ -49501,15 +49528,15 @@ Band 12 range: 0.46569046397212344 at Vector3<0.49999999999999994, 1.75, 0.0> to 0.5451229846661456 at Vector3<0.0, 0.0, 0.0> Gap from band 6 (0.27082126366760045) to band 7 (0.33733710311255777), 21.874512652722238% Gap from band 7 (0.4424976649169414) to band 8 (0.44826277655382296), 1.2944247113988512% -total elapsed time for run: 11.983748435974121 +total elapsed time for run: 14.975551128387451 done -/tmp/meepWcFBDI/test_line_defect-0: 11.99s +/tmp/meephWM0hz/test_line_defect-0: 18.05s -/tmp/meepWcFBDI/test_list_split-0 +/tmp/meephWM0hz/test_list_split-0 ======================== -/tmp/meepWcFBDI/test_list_split-0: 0.00s +/tmp/meephWM0hz/test_list_split-0: 0.00s -/tmp/meepWcFBDI/test_load_and_save_eigenvectors-0 +/tmp/meephWM0hz/test_load_and_save_eigenvectors-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -49552,7 +49579,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002297639846801758 +elapsed time for initialization: 0.002944469451904297 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -49663,7 +49690,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20416736602783203 +elapsed time for k point: 0.2657952308654785 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -49914,7 +49941,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6315736770629883 +elapsed time for k point: 0.8043255805969238 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -49971,7 +49998,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13829946517944336 +elapsed time for k point: 0.18000125885009766 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -50024,7 +50051,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12790870666503906 +elapsed time for k point: 0.22269153594970703 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -50085,7 +50112,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14809226989746094 +elapsed time for k point: 0.1899261474609375 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -50170,7 +50197,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.20871686935424805 +elapsed time for k point: 0.2696554660797119 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -50241,7 +50268,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.1726551055908203 +elapsed time for k point: 0.22196316719055176 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -50302,7 +50329,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14799141883850098 +elapsed time for k point: 0.19252347946166992 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -50355,7 +50382,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12658214569091797 +elapsed time for k point: 0.1652207374572754 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -50407,7 +50434,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12852263450622559 +elapsed time for k point: 0.1425471305847168 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -50459,7 +50486,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12123274803161621 +elapsed time for k point: 0.1278989315032959 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -50500,7 +50527,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09612226486206055 +elapsed time for k point: 0.09551048278808594 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -50547,7 +50574,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11147785186767578 +elapsed time for k point: 0.11088776588439941 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -50610,7 +50637,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.1620182991027832 +elapsed time for k point: 0.1533336639404297 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -50683,7 +50710,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17807269096374512 +elapsed time for k point: 0.20504164695739746 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -50878,7 +50905,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.3568387031555176 +elapsed time for k point: 0.47763514518737793 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -50890,7 +50917,7 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.0635900497436523 +total elapsed time for run: 3.8290274143218994 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -50932,7 +50959,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002243518829345703 +elapsed time for initialization: 0.002965211868286133 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -51043,7 +51070,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.21176791191101074 +elapsed time for k point: 0.2592771053314209 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -51294,7 +51321,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6406421661376953 +elapsed time for k point: 0.8095927238464355 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -51351,7 +51378,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13714599609375 +elapsed time for k point: 0.1781325340270996 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -51404,7 +51431,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12659096717834473 +elapsed time for k point: 0.1683521270751953 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -51465,7 +51492,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14795613288879395 +elapsed time for k point: 0.19205737113952637 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -51550,7 +51577,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.20852136611938477 +elapsed time for k point: 0.27182888984680176 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -51621,7 +51648,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17490553855895996 +elapsed time for k point: 0.22100448608398438 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -51682,7 +51709,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.1476423740386963 +elapsed time for k point: 0.18865537643432617 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -51735,7 +51762,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12668275833129883 +elapsed time for k point: 0.16225242614746094 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -51787,7 +51814,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12191557884216309 +elapsed time for k point: 0.19761967658996582 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -51839,7 +51866,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12175917625427246 +elapsed time for k point: 0.14729952812194824 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -51880,7 +51907,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09614968299865723 +elapsed time for k point: 0.10468482971191406 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -51927,7 +51954,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11144900321960449 +elapsed time for k point: 0.1260073184967041 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -51990,7 +52017,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15253090858459473 +elapsed time for k point: 0.1572551727294922 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -52063,7 +52090,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17844891548156738 +elapsed time for k point: 0.1799609661102295 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -52258,7 +52285,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -.elapsed time for k point: 0.3554196357727051 +.elapsed time for k point: 0.36316466331481934 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -52270,11 +52297,11 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.0627505779266357 +total elapsed time for run: 3.731205701828003 done -/tmp/meepWcFBDI/test_load_and_save_eigenvectors-0: 6.13s +/tmp/meephWM0hz/test_load_and_save_eigenvectors-0: 7.56s -/tmp/meepWcFBDI/test_maximize_first_tm_gap-0 +/tmp/meephWM0hz/test_maximize_first_tm_gap-0 ======================== Initializing eigensolver data Computing 2 bands with 1e-12 tolerance @@ -52317,7 +52344,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0020475387573242188 +elapsed time for initialization: 0.0021898746490478516 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2 Solving for bands 2 to 2... @@ -52356,7 +52383,7 @@ iteration 16: trace = 0.20908352617051 (4.52408e-11% change) Finished solving for bands 2 to 2 after 16 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.457257 -elapsed time for k point: 0.006001472473144531 +elapsed time for k point: 0.006474018096923828 solve_kpoint (0.1,0,0): Solving for bands 1 to 2... linmin: converged after 10 iterations. @@ -52423,7 +52450,7 @@ iteration 30: trace = 0.2014046501599139 (1.70195e-11% change) Finished solving for bands 1 to 2 after 30 iterations. tmfreqs:, 2, 0.1, 0, 0, 0.1, 0.0554835, 0.445338 -elapsed time for k point: 0.02093648910522461 +elapsed time for k point: 0.021315574645996094 solve_kpoint (0.2,0,0): Solving for bands 1 to 2... linmin: converged after 7 iterations. @@ -52446,7 +52473,7 @@ iteration 9: trace = 0.1879007300173179 (4.37972e-11% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 3, 0.2, 0, 0, 0.2, 0.108796, 0.4196 -elapsed time for k point: 0.006578683853149414 +elapsed time for k point: 0.007114410400390625 solve_kpoint (0.3,0,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -52469,7 +52496,7 @@ iteration 9: trace = 0.1768571842568804 (3.89206e-12% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 4, 0.3, 0, 0, 0.3, 0.157121, 0.39009 -elapsed time for k point: 0.006570339202880859 +elapsed time for k point: 0.0071752071380615234 solve_kpoint (0.4,0,0): Solving for bands 1 to 2... linmin: converged after 8 iterations. @@ -52490,7 +52517,7 @@ iteration 8: trace = 0.170163043677122 (4.10389e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 5, 0.4, 0, 0, 0.4, 0.195165, 0.36342 -elapsed time for k point: 0.005939006805419922 +elapsed time for k point: 0.0059664249420166016 solve_kpoint (0.5,0,0): Solving for bands 1 to 2... linmin: converged after 12 iterations. @@ -52511,7 +52538,7 @@ iteration 8: trace = 0.1679542017748687 (3.80752e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 6, 0.5, 0, 0, 0.5, 0.211216, 0.351201 -elapsed time for k point: 0.005884885787963867 +elapsed time for k point: 0.00605463981628418 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 2... linmin: converged after 3 iterations. @@ -52532,7 +52559,7 @@ iteration 8: trace = 0.1727422479677606 (9.4799e-12% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.214395, 0.356057 -elapsed time for k point: 0.00590825080871582 +elapsed time for k point: 0.005835056304931641 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -52553,7 +52580,7 @@ iteration 8: trace = 0.1859937688378515 (2.13546e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.223034, 0.36912 -elapsed time for k point: 0.005889177322387695 +elapsed time for k point: 0.0059947967529296875 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -52574,7 +52601,7 @@ iteration 8: trace = 0.2041420413289721 (7.62339e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.234535, 0.38618 -elapsed time for k point: 0.005899190902709961 +elapsed time for k point: 0.005948781967163086 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -52597,7 +52624,7 @@ iteration 9: trace = 0.2207583578967242 (6.07268e-12% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.244797, 0.40104 -elapsed time for k point: 0.0065953731536865234 +elapsed time for k point: 0.00677037239074707 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -52620,7 +52647,7 @@ iteration 9: trace = 0.2277122843842423 (1.07628e-11% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.249029, 0.407058 -elapsed time for k point: 0.00660395622253418 +elapsed time for k point: 0.0066144466400146484 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -52662,7 +52689,7 @@ iteration 17: trace = 0.2194624955004414 (3.58291e-11% change) Finished solving for bands 1 to 2 after 17 iterations. tmfreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.239439, 0.402656 -elapsed time for k point: 0.011944770812988281 +elapsed time for k point: 0.011947154998779297 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -52685,7 +52712,7 @@ iteration 9: trace = 0.2042021396245496 (5.47766e-12% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.206339, 0.402028 -elapsed time for k point: 0.006546735763549805 +elapsed time for k point: 0.006560564041137695 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 2... linmin: converged after 7 iterations. @@ -52708,7 +52735,7 @@ iteration 9: trace = 0.1959313854307183 (4.6606e-12% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.149555, 0.416611 -elapsed time for k point: 0.006665468215942383 +elapsed time for k point: 0.00664210319519043 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 2... linmin: converged after 9 iterations. @@ -52733,7 +52760,7 @@ iteration 10: trace = 0.2007748484301816 (1.10041e-11% change) Finished solving for bands 1 to 2 after 10 iterations. tmfreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.0779669, 0.441244 -elapsed time for k point: 0.0072383880615234375 +elapsed time for k point: 0.007295846939086914 solve_kpoint (0,0,0): Solving for bands 2 to 2... linmin: converged after 6 iterations. @@ -52762,11 +52789,11 @@ iteration 12: trace = 0.2090835122571491 (3.46474e-11% change) Finished solving for bands 2 to 2 after 12 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.457257 -elapsed time for k point: 0.004395723342895508 +elapsed time for k point: 0.004582405090332031 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.24902949992221993 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.3512008353051186 at Vector3<0.5, 0.0, 0.0> to 0.45725652118970406 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.24902949992221993) to band 2 (0.3512008353051186), 34.04404255716301% -total elapsed time for run: 0.1220400333404541 +total elapsed time for run: 0.12478876113891602 done Initializing eigensolver data Computing 2 bands with 1e-12 tolerance @@ -52808,7 +52835,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00313568115234375 +elapsed time for initialization: 0.003118276596069336 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2 Solving for bands 2 to 2... @@ -52849,7 +52876,7 @@ iteration 17: trace = 0.132652929662027 (9.98886e-11% change) Finished solving for bands 2 to 2 after 17 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.364215 -elapsed time for k point: 0.006208896636962891 +elapsed time for k point: 0.006364107131958008 solve_kpoint (0.1,0,0): Solving for bands 1 to 2... linmin: converged after 11 iterations. @@ -52909,7 +52936,7 @@ iteration 27: trace = 0.1274079622121576 (4.53777e-11% change) Finished solving for bands 1 to 2 after 27 iterations. tmfreqs:, 2, 0.1, 0, 0, 0.1, 0.0438278, 0.354242 -elapsed time for k point: 0.018703460693359375 +elapsed time for k point: 0.019057035446166992 solve_kpoint (0.2,0,0): Solving for bands 1 to 2... linmin: converged after 8 iterations. @@ -52932,7 +52959,7 @@ iteration 9: trace = 0.1169623869301464 (5.37374e-11% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 3, 0.2, 0, 0, 0.2, 0.086595, 0.330853 -elapsed time for k point: 0.00660252571105957 +elapsed time for k point: 0.006715059280395508 solve_kpoint (0.3,0,0): Solving for bands 1 to 2... linmin: converged after 7 iterations. @@ -52955,7 +52982,7 @@ iteration 9: trace = 0.1074794489925547 (2.76318e-12% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 4, 0.3, 0, 0, 0.3, 0.126861, 0.302301 -elapsed time for k point: 0.006589412689208984 +elapsed time for k point: 0.0065593719482421875 solve_kpoint (0.4,0,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -52976,7 +53003,7 @@ iteration 8: trace = 0.1013401281478577 (3.12914e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 5, 0.4, 0, 0, 0.4, 0.161288, 0.274456 -elapsed time for k point: 0.005895137786865234 +elapsed time for k point: 0.0059964656829833984 solve_kpoint (0.5,0,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -52997,7 +53024,7 @@ iteration 8: trace = 0.09924540234965093 (1.06133e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 6, 0.5, 0, 0, 0.5, 0.177897, 0.259996 -elapsed time for k point: 0.005869150161743164 +elapsed time for k point: 0.005971670150756836 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -53018,7 +53045,7 @@ iteration 8: trace = 0.1023441112106414 (1.99331e-12% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.18095, 0.263821 -elapsed time for k point: 0.005905866622924805 +elapsed time for k point: 0.005981922149658203 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -53039,7 +53066,7 @@ iteration 8: trace = 0.1111004875044771 (8.78132e-12% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.189456, 0.274239 -elapsed time for k point: 0.00595855712890625 +elapsed time for k point: 0.006165027618408203 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -53060,7 +53087,7 @@ iteration 8: trace = 0.1236552584709828 (3.20865e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.201452, 0.288223 -elapsed time for k point: 0.0059032440185546875 +elapsed time for k point: 0.005970001220703125 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 2... linmin: converged after 9 iterations. @@ -53083,7 +53110,7 @@ iteration 9: trace = 0.1360211172747792 (1.03251e-11% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.213244, 0.300912 -elapsed time for k point: 0.006548166275024414 +elapsed time for k point: 0.006556510925292969 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 2... linmin: converged after 9 iterations. @@ -53106,7 +53133,7 @@ iteration 9: trace = 0.1415827248187513 (3.30912e-11% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.218623, 0.306246 -elapsed time for k point: 0.006519794464111328 +elapsed time for k point: 0.006719827651977539 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -53156,7 +53183,7 @@ iteration 21: trace = 0.1366069801387 (1.81235e-11% change) Finished solving for bands 1 to 2 after 21 iterations. tmfreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.206544, 0.306507 -elapsed time for k point: 0.014589071273803711 +elapsed time for k point: 0.01479029655456543 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 2... linmin: converged after 7 iterations. @@ -53179,7 +53206,7 @@ iteration 9: trace = 0.1283044775563506 (4.18158e-11% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.171233, 0.314617 -elapsed time for k point: 0.006545305252075195 +elapsed time for k point: 0.0065288543701171875 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 2... linmin: converged after 7 iterations. @@ -53202,7 +53229,7 @@ iteration 9: trace = 0.1250652866471588 (9.25443e-12% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.120346, 0.332539 -elapsed time for k point: 0.0066051483154296875 +elapsed time for k point: 0.006634235382080078 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 2... linmin: converged after 8 iterations. @@ -53227,7 +53254,7 @@ iteration 10: trace = 0.128743150462253 (1.28275e-11% change) Finished solving for bands 1 to 2 after 10 iterations. tmfreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.0617389, 0.353456 -elapsed time for k point: 0.007240772247314453 +elapsed time for k point: 0.00731658935546875 solve_kpoint (0,0,0): Solving for bands 2 to 2... linmin: converged after 4 iterations. @@ -53258,11 +53285,11 @@ iteration 13: trace = 0.1326529452607797 (4.35626e-11% change) Finished solving for bands 2 to 2 after 13 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.364216 -elapsed time for k point: 0.004853487014770508 +elapsed time for k point: 0.005006551742553711 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.21862256910517538 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.259996144374749 at Vector3<0.5, 0.0, 0.0> to 0.36421552034582483 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.21862256910517538) to band 2 (0.259996144374749), 17.288741164655285% -total elapsed time for run: 0.1240379810333252 +total elapsed time for run: 0.12577033042907715 done Initializing eigensolver data Computing 2 bands with 1e-12 tolerance @@ -53304,7 +53331,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0019550323486328125 +elapsed time for initialization: 0.001985788345336914 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2 Solving for bands 2 to 2... @@ -53351,7 +53378,7 @@ iteration 20: trace = 0.298251955149003 (5.18349e-11% change) Finished solving for bands 2 to 2 after 20 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.546124 -elapsed time for k point: 0.007187604904174805 +elapsed time for k point: 0.007418394088745117 solve_kpoint (0.1,0,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -53388,7 +53415,7 @@ iteration 16: trace = 0.2795911378478663 (6.17472e-11% change) Finished solving for bands 1 to 2 after 16 iterations. tmfreqs:, 2, 0.1, 0, 0, 0.1, 0.0654224, 0.524701 -elapsed time for k point: 0.01130223274230957 +elapsed time for k point: 0.011528491973876953 solve_kpoint (0.2,0,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -53413,7 +53440,7 @@ iteration 10: trace = 0.2611842409470009 (6.08917e-11% change) Finished solving for bands 1 to 2 after 10 iterations. tmfreqs:, 3, 0.2, 0, 0, 0.2, 0.128149, 0.494734 -elapsed time for k point: 0.00722503662109375 +elapsed time for k point: 0.007214784622192383 solve_kpoint (0.3,0,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -53436,7 +53463,7 @@ iteration 9: trace = 0.2490993774400129 (1.40728e-11% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 4, 0.3, 0, 0, 0.3, 0.184564, 0.463719 -elapsed time for k point: 0.006609201431274414 +elapsed time for k point: 0.006527423858642578 solve_kpoint (0.4,0,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -53457,7 +53484,7 @@ iteration 8: trace = 0.2424457144899839 (6.6136e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 5, 0.4, 0, 0, 0.4, 0.228088, 0.436373 -elapsed time for k point: 0.005881547927856445 +elapsed time for k point: 0.0059893131256103516 solve_kpoint (0.5,0,0): Solving for bands 1 to 2... linmin: converged after 10 iterations. @@ -53478,7 +53505,7 @@ iteration 8: trace = 0.2403442724329469 (2.8709e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 6, 0.5, 0, 0, 0.5, 0.245908, 0.424115 -elapsed time for k point: 0.005888938903808594 +elapsed time for k point: 0.006105184555053711 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -53499,7 +53526,7 @@ iteration 8: trace = 0.2478135698278219 (2.71044e-12% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.249363, 0.43085 -elapsed time for k point: 0.005881786346435547 +elapsed time for k point: 0.0062046051025390625 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -53520,7 +53547,7 @@ iteration 8: trace = 0.2687921840070467 (1.52206e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.258652, 0.449323 -elapsed time for k point: 0.005897045135498047 +elapsed time for k point: 0.00596165657043457 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -53541,7 +53568,7 @@ iteration 8: trace = 0.2984106619036125 (7.54322e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.270746, 0.474454 -elapsed time for k point: 0.005860567092895508 +elapsed time for k point: 0.005968570709228516 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 2... linmin: converged after 6 iterations. @@ -53564,7 +53591,7 @@ iteration 9: trace = 0.3267691033102513 (4.19601e-12% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.281204, 0.497688 -elapsed time for k point: 0.00654911994934082 +elapsed time for k point: 0.00656580924987793 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 2... linmin: converged after 6 iterations. @@ -53587,7 +53614,7 @@ iteration 9: trace = 0.3391341088633687 (2.86776e-11% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.285404, 0.507621 -elapsed time for k point: 0.006556987762451172 +elapsed time for k point: 0.006670951843261719 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -53626,7 +53653,7 @@ iteration 17: trace = 0.3215197827688706 (6.92163e-11% change) Finished solving for bands 1 to 2 after 17 iterations. tmfreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.275795, 0.495436 -elapsed time for k point: 0.011896371841430664 +elapsed time for k point: 0.01195836067199707 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -53649,7 +53676,7 @@ iteration 9: trace = 0.2901214013723646 (2.08175e-11% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.240471, 0.48197 -elapsed time for k point: 0.006541252136230469 +elapsed time for k point: 0.006524562835693359 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -53674,7 +53701,7 @@ iteration 10: trace = 0.2708607258851711 (6.14831e-12% change) Finished solving for bands 1 to 2 after 10 iterations. tmfreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.175771, 0.489863 -elapsed time for k point: 0.007204532623291016 +elapsed time for k point: 0.00728607177734375 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 2... linmin: converged after 7 iterations. @@ -53701,7 +53728,7 @@ iteration 11: trace = 0.2750943676881145 (3.71293e-12% change) Finished solving for bands 1 to 2 after 11 iterations. tmfreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.0919053, 0.51638 -elapsed time for k point: 0.007914066314697266 +elapsed time for k point: 0.008300065994262695 solve_kpoint (0,0,0): Solving for bands 2 to 2... linmin: converged after 5 iterations. @@ -53738,11 +53765,11 @@ iteration 16: trace = 0.2982519551492236 (9.19627e-11% change) Finished solving for bands 2 to 2 after 16 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.546124 -elapsed time for k point: 0.005771636962890625 +elapsed time for k point: 0.006018161773681641 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.2854038105785692 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4241150516194396 at Vector3<0.5, 0.0, 0.0> to 0.5461244868610305 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.2854038105785692) to band 2 (0.4241150516194396), 39.10008554562137% -total elapsed time for run: 0.11643314361572266 +total elapsed time for run: 0.11854243278503418 done Initializing eigensolver data Computing 2 bands with 1e-12 tolerance @@ -53784,7 +53811,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0020923614501953125 +elapsed time for initialization: 0.002058744430541992 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2 Solving for bands 2 to 2... @@ -53819,7 +53846,7 @@ iteration 14: trace = 0.3025956959406486 (2.02162e-11% change) Finished solving for bands 2 to 2 after 14 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.550087 -elapsed time for k point: 0.005174160003662109 +elapsed time for k point: 0.0054318904876708984 solve_kpoint (0.1,0,0): Solving for bands 1 to 2... linmin: converged after 6 iterations. @@ -53844,7 +53871,7 @@ iteration 10: trace = 0.3009297177018308 (7.18309e-11% change) Finished solving for bands 1 to 2 after 10 iterations. tmfreqs:, 2, 0.1, 0, 0, 0.1, 0.0721945, 0.543799 -elapsed time for k point: 0.007295370101928711 +elapsed time for k point: 0.0073909759521484375 solve_kpoint (0.2,0,0): Solving for bands 1 to 2... linmin: converged after 7 iterations. @@ -53869,7 +53896,7 @@ iteration 10: trace = 0.2969598361818405 (3.28439e-11% change) Finished solving for bands 1 to 2 after 10 iterations. tmfreqs:, 3, 0.2, 0, 0, 0.2, 0.141724, 0.526188 -elapsed time for k point: 0.007277727127075195 +elapsed time for k point: 0.00753474235534668 solve_kpoint (0.3,0,0): Solving for bands 1 to 2... linmin: converged after 14 iterations. @@ -53894,7 +53921,7 @@ iteration 10: trace = 0.2926449175807001 (3.66097e-12% change) Finished solving for bands 1 to 2 after 10 iterations. tmfreqs:, 4, 0.3, 0, 0, 0.3, 0.204809, 0.500698 -elapsed time for k point: 0.007239341735839844 +elapsed time for k point: 0.007241487503051758 solve_kpoint (0.4,0,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -53917,7 +53944,7 @@ iteration 9: trace = 0.2895143959121309 (5.63712e-12% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 5, 0.4, 0, 0, 0.4, 0.254113, 0.474279 -elapsed time for k point: 0.006540060043334961 +elapsed time for k point: 0.006570100784301758 solve_kpoint (0.5,0,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -53938,7 +53965,7 @@ iteration 8: trace = 0.2883886767737718 (2.70445e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 6, 0.5, 0, 0, 0.5, 0.274582, 0.461512 -elapsed time for k point: 0.005931377410888672 +elapsed time for k point: 0.005986213684082031 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -53959,7 +53986,7 @@ iteration 8: trace = 0.2982086196943481 (6.68274e-12% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.278369, 0.469808 -elapsed time for k point: 0.005863189697265625 +elapsed time for k point: 0.005960941314697266 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -53980,7 +54007,7 @@ iteration 8: trace = 0.3264979228223411 (2.75432e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.288519, 0.493208 -elapsed time for k point: 0.0058956146240234375 +elapsed time for k point: 0.005887031555175781 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -54001,7 +54028,7 @@ iteration 8: trace = 0.369066417318032 (8.28757e-11% change) Finished solving for bands 1 to 2 after 8 iterations. tmfreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.301662, 0.52732 -elapsed time for k point: 0.005887031555175781 +elapsed time for k point: 0.00597381591796875 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 2... linmin: converged after 4 iterations. @@ -54026,7 +54053,7 @@ iteration 10: trace = 0.4155447999210048 (6.05147e-12% change) Finished solving for bands 1 to 2 after 10 iterations. tmfreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.312941, 0.563571 -elapsed time for k point: 0.0072443485260009766 +elapsed time for k point: 0.007359027862548828 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 2... linmin: converged after 6 iterations. @@ -54051,7 +54078,7 @@ iteration 10: trace = 0.4398182199057509 (3.19952e-11% change) Finished solving for bands 1 to 2 after 10 iterations. tmfreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.317444, 0.582278 -elapsed time for k point: 0.007250308990478516 +elapsed time for k point: 0.007332563400268555 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -54090,7 +54117,7 @@ iteration 17: trace = 0.4024754384446907 (8.99267e-12% change) Finished solving for bands 1 to 2 after 17 iterations. tmfreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.307036, 0.555161 -elapsed time for k point: 0.011987447738647461 +elapsed time for k point: 0.012013673782348633 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -54113,7 +54140,7 @@ iteration 9: trace = 0.3476919187043949 (5.9919e-11% change) Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.267668, 0.5254 -elapsed time for k point: 0.006542205810546875 +elapsed time for k point: 0.006545543670654297 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 2... linmin: converged after 5 iterations. @@ -54138,7 +54165,7 @@ iteration 10: trace = 0.3124701859233177 (7.26599e-12% change) Finished solving for bands 1 to 2 after 10 iterations. tmfreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.194886, 0.523918 -elapsed time for k point: 0.007188320159912109 +elapsed time for k point: 0.0073091983795166016 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 2... linmin: converged after 6 iterations. @@ -54163,7 +54190,7 @@ iteration 10: trace = 0.3014386377955973 (5.1821e-11% change) Finished solving for bands 1 to 2 after 10 iterations. tmfreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.101494, 0.539572 -elapsed time for k point: 0.00725102424621582 +elapsed time for k point: 0.007454395294189453 solve_kpoint (0,0,0): Solving for bands 2 to 2... linmin: converged after 6 iterations. @@ -54192,15 +54219,15 @@ iteration 12: trace = 0.3025956959406537 (2.06748e-11% change) Finished solving for bands 2 to 2 after 12 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.550087 -.elapsed time for k point: 0.004410505294799805 +.elapsed time for k point: 0.004583120346069336 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.3174441229723216 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4615121898996916 at Vector3<0.5, 0.0, 0.0> to 0.5822778105819292 at Vector3<0.5, 0.5, 0.0> Gap from band 1 (0.3174441229723216) to band 2 (0.4615121898996916), 36.99002486960811% -total elapsed time for run: 0.11140847206115723 +total elapsed time for run: 0.1129448413848877 done -/tmp/meepWcFBDI/test_maximize_first_tm_gap-0: 0.47s +/tmp/meephWM0hz/test_maximize_first_tm_gap-0: 0.48s -/tmp/meepWcFBDI/test_multiply_bloch_in_mpb_data-0 +/tmp/meephWM0hz/test_multiply_bloch_in_mpb_data-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -54243,7 +54270,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0023779869079589844 +elapsed time for initialization: 0.0023279190063476562 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -54354,7 +54381,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.2022085189819336 +elapsed time for k point: 0.20134711265563965 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -54605,7 +54632,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6312425136566162 +elapsed time for k point: 0.6216986179351807 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -54662,7 +54689,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13793516159057617 +elapsed time for k point: 0.13947033882141113 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -54715,7 +54742,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12756013870239258 +elapsed time for k point: 0.12705183029174805 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -54776,7 +54803,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14838480949401855 +elapsed time for k point: 0.14758682250976562 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -54861,7 +54888,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.21184444427490234 +elapsed time for k point: 0.20949101448059082 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -54932,7 +54959,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17300820350646973 +elapsed time for k point: 0.17144083976745605 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -54993,7 +55020,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14715027809143066 +elapsed time for k point: 0.14681506156921387 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -55046,7 +55073,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12694406509399414 +elapsed time for k point: 0.1250290870666504 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -55098,7 +55125,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12164783477783203 +elapsed time for k point: 0.12150001525878906 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -55150,7 +55177,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12130260467529297 +elapsed time for k point: 0.12258386611938477 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -55191,7 +55218,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09608101844787598 +elapsed time for k point: 0.09680414199829102 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -55238,7 +55265,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11149215698242188 +elapsed time for k point: 0.11113405227661133 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -55301,7 +55328,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.1522207260131836 +elapsed time for k point: 0.15500092506408691 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -55374,7 +55401,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17830109596252441 +elapsed time for k point: 0.17946386337280273 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -55569,7 +55596,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.3661777973175049 +elapsed time for k point: 0.3545820713043213 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -55581,7 +55608,7 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.0568695068359375 +total elapsed time for run: 3.0343196392059326 done Fixing e-field (band 8) phase by 2.59056e-07 + 1i; max ampl. = 1.10099 real part range: -1.10098 .. 1.10098 @@ -55630,7 +55657,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002229452133178711 +elapsed time for initialization: 0.002277374267578125 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -55741,7 +55768,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20088529586791992 +elapsed time for k point: 0.2005624771118164 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -55992,7 +56019,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6240873336791992 +elapsed time for k point: 0.6226387023925781 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56049,7 +56076,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13692283630371094 +elapsed time for k point: 0.13721871376037598 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56102,7 +56129,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12628960609436035 +elapsed time for k point: 0.1270456314086914 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56163,7 +56190,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.1466388702392578 +elapsed time for k point: 0.14783930778503418 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56248,7 +56275,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.2077476978302002 +elapsed time for k point: 0.20810914039611816 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -56319,7 +56346,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17211389541625977 +elapsed time for k point: 0.17330121994018555 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56380,7 +56407,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14704060554504395 +elapsed time for k point: 0.14876985549926758 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56433,7 +56460,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12651968002319336 +elapsed time for k point: 0.12606167793273926 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56485,7 +56512,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12165617942810059 +elapsed time for k point: 0.12137007713317871 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56537,7 +56564,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.19520282745361328 +elapsed time for k point: 0.12328529357910156 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56578,7 +56605,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09775900840759277 +elapsed time for k point: 0.09902262687683105 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56625,7 +56652,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.1112673282623291 +elapsed time for k point: 0.11216998100280762 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56688,7 +56715,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15192627906799316 +elapsed time for k point: 0.15125370025634766 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -56761,7 +56788,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.1772472858428955 +elapsed time for k point: 0.1772770881652832 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -56956,7 +56983,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.35817623138427734 +elapsed time for k point: 0.3579733371734619 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -56968,7 +56995,7 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.104734420776367 +total elapsed time for run: 3.0374128818511963 done Fixing e-field (band 8) phase by 2.59056e-07 + 1i; max ampl. = 1.10099 real part range: -1.10098 .. 1.10098 @@ -56977,9 +57004,9 @@ imag part range: -0.00766496 .. 0.00870069 real part range: 0 .. 0 imag part range: 0 .. 0 -./tmp/meepWcFBDI/test_multiply_bloch_in_mpb_data-0: 6.22s +./tmp/meephWM0hz/test_multiply_bloch_in_mpb_data-0: 6.13s -/tmp/meepWcFBDI/test_multiply_bloch_phase-0 +/tmp/meephWM0hz/test_multiply_bloch_phase-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -57022,7 +57049,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0023374557495117188 +elapsed time for initialization: 0.0026090145111083984 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -57133,7 +57160,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20325803756713867 +elapsed time for k point: 0.20215535163879395 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -57384,7 +57411,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6256599426269531 +elapsed time for k point: 0.6264910697937012 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -57441,7 +57468,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.1371300220489502 +elapsed time for k point: 0.1375885009765625 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -57494,7 +57521,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12686395645141602 +elapsed time for k point: 0.12909936904907227 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -57555,7 +57582,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.1475238800048828 +elapsed time for k point: 0.15141797065734863 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -57640,7 +57667,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.20902585983276367 +elapsed time for k point: 0.2523813247680664 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -57711,7 +57738,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.1731879711151123 +elapsed time for k point: 0.2254619598388672 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -57772,7 +57799,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14734196662902832 +elapsed time for k point: 0.18966364860534668 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -57825,7 +57852,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.1265089511871338 +elapsed time for k point: 0.16367554664611816 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -57877,7 +57904,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12115192413330078 +elapsed time for k point: 0.19309377670288086 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -57929,7 +57956,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.1206669807434082 +elapsed time for k point: 0.1516110897064209 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -57970,7 +57997,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.17601561546325684 +elapsed time for k point: 0.12027621269226074 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -58017,7 +58044,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11141705513000488 +elapsed time for k point: 0.14950346946716309 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -58080,7 +58107,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15192413330078125 +elapsed time for k point: 0.20151519775390625 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -58153,7 +58180,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17752885818481445 +elapsed time for k point: 0.2287752628326416 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -58348,7 +58375,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.35813260078430176 +elapsed time for k point: 0.479900598526001 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -58360,12 +58387,12 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.116659641265869 +total elapsed time for run: 3.606389045715332 done Fixing e-field (band 8) phase by 2.59056e-07 + 1i; max ampl. = 1.10099 -./tmp/meepWcFBDI/test_multiply_bloch_phase-0: 3.13s +./tmp/meephWM0hz/test_multiply_bloch_phase-0: 3.61s -/tmp/meepWcFBDI/test_output_charge_density-0 +/tmp/meephWM0hz/test_output_charge_density-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -58408,7 +58435,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0023517608642578125 +elapsed time for initialization: 0.002418994903564453 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -58519,7 +58546,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.2020862102508545 +elapsed time for k point: 0.20156526565551758 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -58770,7 +58797,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.628671407699585 +elapsed time for k point: 0.6827049255371094 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -58827,7 +58854,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13696026802062988 +elapsed time for k point: 0.17892718315124512 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -58880,7 +58907,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12631845474243164 +elapsed time for k point: 0.16463685035705566 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -58941,7 +58968,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14776825904846191 +elapsed time for k point: 0.19303464889526367 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -59026,7 +59053,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.20991301536560059 +elapsed time for k point: 0.27039122581481934 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -59097,7 +59124,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.1721179485321045 +elapsed time for k point: 0.2228708267211914 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -59158,7 +59185,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.1467888355255127 +elapsed time for k point: 0.18988680839538574 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -59211,7 +59238,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.1264951229095459 +elapsed time for k point: 0.1629173755645752 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -59263,7 +59290,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12127280235290527 +elapsed time for k point: 0.14455246925354004 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -59315,7 +59342,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.1209261417388916 +elapsed time for k point: 0.12762713432312012 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -59356,7 +59383,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09569287300109863 +elapsed time for k point: 0.09476351737976074 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -59403,7 +59430,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11116981506347656 +elapsed time for k point: 0.1123199462890625 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -59466,7 +59493,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15181970596313477 +elapsed time for k point: 0.15210556983947754 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -59539,7 +59566,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.1776113510131836 +elapsed time for k point: 0.17895746231079102 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -59734,7 +59761,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.39795708656311035 +elapsed time for k point: 0.35921740531921387 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -59746,13 +59773,13 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.076873779296875 +total elapsed time for run: 3.4401087760925293 done Fixing e-field (band 8) phase by 2.59056e-07 + 1i; max ampl. = 1.10099 -.Outputting complex scalar field to /tmp/meepWcFBDI/test_output_charge_density-0-C.k16.b08.te.h5... -/tmp/meepWcFBDI/test_output_charge_density-0: 3.09s +.Outputting complex scalar field to /tmp/meephWM0hz/test_output_charge_density-0-C.k16.b08.te.h5... +/tmp/meephWM0hz/test_output_charge_density-0: 4.04s -/tmp/meepWcFBDI/test_output_dpwr_in_objects-0 +/tmp/meephWM0hz/test_output_dpwr_in_objects-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -59795,7 +59822,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002318143844604492 +elapsed time for initialization: 0.00316619873046875 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -59906,12 +59933,12 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20708346366882324 +elapsed time for k point: 0.2687873840332031 D-energy-components:, 1, 1, 0, 0, 0 dpwr:, 1, 0.0, 0.0 D-energy-components:, 1, 2, 0.500003, 0.499997, 0 dpwr:, 2, 0.5527092320102549, 0.8567435000049454 -Outputting fields to /tmp/meepWcFBDI/test_output_dpwr_in_objects-0-d.k01.b02.te.h5... +Outputting fields to /tmp/meephWM0hz/test_output_dpwr_in_objects-0-d.k01.b02.te.h5... D-energy-components:, 1, 3, 0.455928, 0.544072, 0 dpwr:, 3, 0.773226559306942, 0.528826055798308 D-energy-components:, 1, 4, 0.544076, 0.455924, 0 @@ -60174,7 +60201,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6834754943847656 +elapsed time for k point: 0.8090450763702393 D-energy-components:, 2, 1, 0.0311142, 0.968886, 0 dpwr:, 1, 0.08973322605272574, 0.04603176935253569 D-energy-components:, 2, 2, 0.488088, 0.511912, 0 @@ -60247,7 +60274,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13689160346984863 +elapsed time for k point: 0.17773222923278809 D-energy-components:, 3, 1, 0.0363561, 0.963644, 0 dpwr:, 1, 0.1786920044640264, 0.05442207263324207 D-energy-components:, 3, 2, 0.446363, 0.553637, 0 @@ -60316,7 +60343,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.1346728801727295 +elapsed time for k point: 0.16249322891235352 D-energy-components:, 4, 1, 0.0468976, 0.953102, 0 dpwr:, 1, 0.26579760671574754, 0.07189021129173066 D-energy-components:, 4, 2, 0.35602, 0.64398, 0 @@ -60393,7 +60420,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.15337824821472168 +elapsed time for k point: 0.18968701362609863 D-energy-components:, 5, 1, 0.0662302, 0.93377, 0 dpwr:, 1, 0.34895594992452605, 0.10384524472152631 D-energy-components:, 5, 2, 0.226367, 0.773633, 0 @@ -60494,7 +60521,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.22376084327697754 +elapsed time for k point: 0.2699766159057617 D-energy-components:, 6, 1, 0.0773009, 0.922699, 0 dpwr:, 1, 0.41279067126554697, 0.08603997803833881 D-energy-components:, 6, 2, 0.165167, 0.834833, 0 @@ -60581,7 +60608,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17247653007507324 +elapsed time for k point: 0.22604894638061523 D-energy-components:, 7, 1, 0.12807, 0.87193, 0 dpwr:, 1, 0.4237414613237788, 0.08405292710461983 D-energy-components:, 7, 2, 0.190236, 0.809764, 0 @@ -60658,7 +60685,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14667057991027832 +elapsed time for k point: 0.18915486335754395 D-energy-components:, 8, 1, 0.253956, 0.746044, 0 dpwr:, 1, 0.45478127251547157, 0.08020083733719262 D-energy-components:, 8, 2, 0.258536, 0.741464, 0 @@ -60727,7 +60754,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.22993874549865723 +elapsed time for k point: 0.15022826194763184 D-energy-components:, 9, 1, 0.353246, 0.646754, 0 dpwr:, 1, 0.47376659593612197, 0.5125827722132725 D-energy-components:, 9, 2, 0.406264, 0.593736, 0 @@ -60795,7 +60822,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12871623039245605 +elapsed time for k point: 0.12874269485473633 D-energy-components:, 10, 1, 0.450645, 0.549355, 0 dpwr:, 1, 0.4896492003298962, 0.6285469371615329 D-energy-components:, 10, 2, 0.55965, 0.44035, 0 @@ -60863,7 +60890,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12990713119506836 +elapsed time for k point: 0.12003779411315918 D-energy-components:, 11, 1, 0.500002, 0.499998, 0 dpwr:, 1, 0.49683586474489877, 0.6986360262353928 D-energy-components:, 11, 2, 0.490408, 0.509592, 0 @@ -60920,7 +60947,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.18605279922485352 +elapsed time for k point: 0.09460139274597168 D-energy-components:, 12, 1, 0.500001, 0.499999, 0 dpwr:, 1, 0.4709868954434175, 0.4184573101767129 D-energy-components:, 12, 2, 0.5, 0.5, 0 @@ -60983,7 +61010,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.1162421703338623 +elapsed time for k point: 0.1107795238494873 D-energy-components:, 13, 1, 0.499999, 0.500001, 0 dpwr:, 1, 0.372434676912902, 0.12237408338023685 D-energy-components:, 13, 2, 0.500002, 0.499998, 0 @@ -61062,7 +61089,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15192198753356934 +elapsed time for k point: 0.15169858932495117 D-energy-components:, 14, 1, 0.499999, 0.500001, 0 dpwr:, 1, 0.25208809622874284, 0.065372229886201 D-energy-components:, 14, 2, 0.500003, 0.499997, 0 @@ -61151,7 +61178,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.18003344535827637 +elapsed time for k point: 0.18442511558532715 D-energy-components:, 15, 1, 0.499999, 0.500001, 0 dpwr:, 1, 0.12684106903469353, 0.04795279770419718 D-energy-components:, 15, 2, 0.500003, 0.499997, 0 @@ -61362,12 +61389,12 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.3563354015350342 +elapsed time for k point: 0.45952916145324707 D-energy-components:, 16, 1, 0, 0, 0 dpwr:, 1, 0.0, 0.0 D-energy-components:, 16, 2, 0.500003, 0.499997, 0 dpwr:, 2, 0.552709232010199, 0.8567434642231009 -Outputting fields to /tmp/meepWcFBDI/test_output_dpwr_in_objects-0-d.k16.b02.te.h5... +Outputting fields to /tmp/meephWM0hz/test_output_dpwr_in_objects-0-d.k16.b02.te.h5... D-energy-components:, 16, 3, 0.455928, 0.544072, 0 dpwr:, 3, 0.7732265593069757, 0.5288260828553547 D-energy-components:, 16, 4, 0.544076, 0.455924, 0 @@ -61391,11 +61418,11 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.484938621520996 +total elapsed time for run: 3.860816717147827 done -/tmp/meepWcFBDI/test_output_dpwr_in_objects-0: 3.49s +/tmp/meephWM0hz/test_output_dpwr_in_objects-0: 3.86s -/tmp/meepWcFBDI/test_output_efield_z-0 +/tmp/meephWM0hz/test_output_efield_z-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -61438,7 +61465,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0023636817932128906 +elapsed time for initialization: 0.003083467483520508 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8 Solving for bands 2 to 8... @@ -61574,7 +61601,7 @@ iteration 61: trace = 4.373720851032935 (3.72636e-11% change) Finished solving for bands 2 to 8 after 61 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.546027, 0.552094, 0.552096, 0.812093, 0.854314, 0.951107, 1.08259 -elapsed time for k point: 0.2429189682006836 +elapsed time for k point: 0.30284571647644043 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -61625,7 +61652,7 @@ iteration 23: trace = 4.290857263081674 (9.18222e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tmfreqs:, 2, 0.1, 0, 0, 0.1, 0.0643671, 0.518896, 0.552617, 0.579095, 0.812721, 0.852958, 0.941428, 1.04995 -elapsed time for k point: 0.13457989692687988 +elapsed time for k point: 0.15615582466125488 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -61656,7 +61683,7 @@ iteration 13: trace = 4.208307958519126 (3.87705e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 3, 0.2, 0, 0, 0.2, 0.126061, 0.48795, 0.553991, 0.610359, 0.812384, 0.849484, 0.912816, 1.02959 -elapsed time for k point: 0.07020974159240723 +elapsed time for k point: 0.09083795547485352 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -61687,7 +61714,7 @@ iteration 13: trace = 4.150444015828809 (1.03146e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 4, 0.3, 0, 0, 0.3, 0.181523, 0.45665, 0.555709, 0.644685, 0.802314, 0.845326, 0.880698, 1.025 -elapsed time for k point: 0.07006144523620605 +elapsed time for k point: 0.08974957466125488 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -61718,7 +61745,7 @@ iteration 13: trace = 4.119598598621692 (1.07152e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 5, 0.4, 0, 0, 0.4, 0.224302, 0.429317, 0.557116, 0.682524, 0.772176, 0.842059, 0.865404, 1.0269 -elapsed time for k point: 0.07022905349731445 +elapsed time for k point: 0.09007501602172852 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -61749,7 +61776,7 @@ iteration 13: trace = 4.110777242725125 (6.68925e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 6, 0.5, 0, 0, 0.5, 0.241821, 0.417114, 0.557658, 0.713395, 0.741311, 0.84083, 0.862516, 1.02856 -elapsed time for k point: 0.07025980949401855 +elapsed time for k point: 0.09049582481384277 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -61778,7 +61805,7 @@ iteration 12: trace = 4.0994899642748 (2.49804e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.245235, 0.4236, 0.551085, 0.711571, 0.749855, 0.841982, 0.862609, 1.01714 -elapsed time for k point: 0.07312512397766113 +elapsed time for k point: 0.0880575180053711 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -61805,7 +61832,7 @@ iteration 11: trace = 4.079452895803482 (8.21458e-11% change) Finished solving for bands 1 to 8 after 11 iterations. tmfreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.25442, 0.441321, 0.535034, 0.706018, 0.772267, 0.845818, 0.862861, 0.989395 -elapsed time for k point: 0.06008291244506836 +elapsed time for k point: 0.07773017883300781 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -61834,7 +61861,7 @@ iteration 12: trace = 4.068759276129136 (1.19842e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.266397, 0.465222, 0.516482, 0.697068, 0.802974, 0.853388, 0.863228, 0.954203 -elapsed time for k point: 0.06506681442260742 +elapsed time for k point: 0.08379673957824707 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -61867,7 +61894,7 @@ iteration 14: trace = 4.07552694934967 (2.61298e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.276774, 0.48701, 0.501823, 0.687264, 0.837704, 0.86397, 0.865932, 0.916273 -elapsed time for k point: 0.07509922981262207 +elapsed time for k point: 0.10098123550415039 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -61902,7 +61929,7 @@ iteration 15: trace = 4.092150433618252 (9.12672e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.280948, 0.496196, 0.496197, 0.682617, 0.859474, 0.878316, 0.878316, 0.879351 -elapsed time for k point: 0.08119010925292969 +elapsed time for k point: 0.10326027870178223 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -61939,7 +61966,7 @@ iteration 16: trace = 4.046652183676487 (2.11583e-11% change) Finished solving for bands 1 to 8 after 16 iterations. tmfreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.27141, 0.485365, 0.501693, 0.689111, 0.830636, 0.844978, 0.893706, 0.898991 -elapsed time for k point: 0.0957188606262207 +elapsed time for k point: 0.11475682258605957 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -61968,7 +61995,7 @@ iteration 12: trace = 4.044513236396849 (3.20398e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.236529, 0.473888, 0.515941, 0.679199, 0.819377, 0.829518, 0.897603, 0.933446 -elapsed time for k point: 0.06928706169128418 +elapsed time for k point: 0.08735084533691406 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -61997,7 +62024,7 @@ iteration 12: trace = 4.113415259755491 (2.54788e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.172884, 0.482973, 0.533242, 0.640233, 0.819202, 0.838111, 0.910409, 0.976551 -elapsed time for k point: 0.06515693664550781 +elapsed time for k point: 0.08510041236877441 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -62030,7 +62057,7 @@ iteration 14: trace = 4.240749642028247 (2.11115e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.0904174, 0.510404, 0.546943, 0.593803, 0.81373, 0.851132, 0.935551, 1.02882 -elapsed time for k point: 0.07584524154663086 +elapsed time for k point: 0.09884858131408691 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 4 iterations. @@ -62162,7 +62189,7 @@ iteration 59: trace = 4.373720851594641 (8.85798e-11% change) Finished solving for bands 2 to 8 after 59 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.546027, 0.552094, 0.552096, 0.812093, 0.854314, 0.951107, 1.08259 -elapsed time for k point: 0.2302851676940918 +elapsed time for k point: 0.3022315502166748 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.28094795352537405 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.41711424932466357 at Vector3<0.5, 0.0, 0.0> to 0.5460267793370319 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.4961974527654609 at Vector3<0.5, 0.5, 0.0> to 0.5576576362977237 at Vector3<0.5, 0.0, 0.0> @@ -62173,13 +62200,13 @@ Band 8 range: 0.8793510958294798 at Vector3<0.5, 0.5, 0.0> to 1.0825923841452598 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.28094795352537405) to band 2 (0.41711424932466357), 39.0126539564388% Gap from band 4 (0.7133951516423509) to band 5 (0.7413109657068664), 3.8380005049245294% -total elapsed time for run: 1.552497386932373 +total elapsed time for run: 1.9665107727050781 done Fixing e-field (band 8) phase by 2.54672e-08 + -1i; max ampl. = 1.49941 -.Outputting fields to /tmp/meepWcFBDI/test_output_efield_z-0-e.k16.b08.z.tm.h5... -/tmp/meepWcFBDI/test_output_efield_z-0: 1.74s +.Outputting fields to /tmp/meephWM0hz/test_output_efield_z-0-e.k16.b08.z.tm.h5... +/tmp/meephWM0hz/test_output_efield_z-0: 1.98s -/tmp/meepWcFBDI/test_output_field_to_file-0 +/tmp/meephWM0hz/test_output_field_to_file-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -62222,7 +62249,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0023925304412841797 +elapsed time for initialization: 0.0033075809478759766 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -62333,7 +62360,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.21361708641052246 +elapsed time for k point: 0.2578291893005371 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -62584,7 +62611,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6277210712432861 +elapsed time for k point: 0.8121366500854492 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -62641,7 +62668,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13815736770629883 +elapsed time for k point: 0.1765894889831543 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -62694,7 +62721,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.1276247501373291 +elapsed time for k point: 0.16788101196289062 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -62755,7 +62782,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14922738075256348 +elapsed time for k point: 0.18803715705871582 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -62840,7 +62867,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.21072149276733398 +elapsed time for k point: 0.24304795265197754 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -62911,7 +62938,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17333459854125977 +elapsed time for k point: 0.17770600318908691 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -62972,7 +62999,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14991426467895508 +elapsed time for k point: 0.1494591236114502 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -63025,7 +63052,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12717175483703613 +elapsed time for k point: 0.14497900009155273 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -63077,7 +63104,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12224364280700684 +elapsed time for k point: 0.15750479698181152 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -63129,7 +63156,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12156987190246582 +elapsed time for k point: 0.15595459938049316 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -63170,7 +63197,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09638428688049316 +elapsed time for k point: 0.12287235260009766 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -63217,7 +63244,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11202192306518555 +elapsed time for k point: 0.14245390892028809 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -63280,7 +63307,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15279221534729004 +elapsed time for k point: 0.19450926780700684 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -63353,7 +63380,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.1785118579864502 +elapsed time for k point: 0.22804570198059082 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -63548,7 +63575,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.3580920696258545 +elapsed time for k point: 0.45118117332458496 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -63560,13 +63587,13 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.0625216960906982 +total elapsed time for run: 3.774613380432129 done epsilon: 1-12, mean 2.38229, harm. mean 1.1448, 14.5508% > 1, 12.5663% "fill" -.Outputting /tmp/meepWcFBDI/test_output_field_to_file-0-epsilon.h5... -/tmp/meepWcFBDI/test_output_field_to_file-0: 3.36s +.Outputting /tmp/meephWM0hz/test_output_field_to_file-0-epsilon.h5... +/tmp/meephWM0hz/test_output_field_to_file-0: 3.79s -/tmp/meepWcFBDI/test_output_tot_pwr-0 +/tmp/meephWM0hz/test_output_tot_pwr-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -63609,7 +63636,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0024259090423583984 +elapsed time for initialization: 0.0028214454650878906 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -63720,7 +63747,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.21518445014953613 +elapsed time for k point: 0.24855899810791016 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -63971,7 +63998,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6336019039154053 +elapsed time for k point: 0.8026621341705322 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64028,7 +64055,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.14357566833496094 +elapsed time for k point: 0.17641234397888184 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64081,7 +64108,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12847042083740234 +elapsed time for k point: 0.16327643394470215 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64142,7 +64169,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.1485133171081543 +elapsed time for k point: 0.18961000442504883 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64227,7 +64254,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.2105565071105957 +elapsed time for k point: 0.2659611701965332 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -64298,7 +64325,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17482638359069824 +elapsed time for k point: 0.19586753845214844 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64359,7 +64386,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14850449562072754 +elapsed time for k point: 0.14684295654296875 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64412,7 +64439,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12830543518066406 +elapsed time for k point: 0.12533211708068848 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64464,7 +64491,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12333989143371582 +elapsed time for k point: 0.1199648380279541 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64516,7 +64543,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12251901626586914 +elapsed time for k point: 0.11934351921081543 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64557,7 +64584,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09847450256347656 +elapsed time for k point: 0.09449172019958496 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64604,7 +64631,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11386871337890625 +elapsed time for k point: 0.11024713516235352 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64667,7 +64694,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.32866883277893066 +elapsed time for k point: 0.1525135040283203 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -64740,7 +64767,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17879486083984375 +elapsed time for k point: 0.17769432067871094 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -64935,7 +64962,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.35946011543273926 +elapsed time for k point: 0.35430407524108887 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -64947,16 +64974,16 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.2602732181549072 +total elapsed time for run: 3.446986436843872 done D-energy-components:, 16, 8, 0.499991, 0.500009, 0 B-energy-components:, 16, 8, 0, 0, 1 -Outputting /tmp/meepWcFBDI/test_output_tot_pwr-0-tot.rpwr.k16.b08.te.h5... +Outputting /tmp/meephWM0hz/test_output_tot_pwr-0-tot.rpwr.k16.b08.te.h5... D-energy-components:, 16, 8, 0.499991, 0.500009, 0 B-energy-components:, 16, 8, 0, 0, 1 -./tmp/meepWcFBDI/test_output_tot_pwr-0: 3.27s +./tmp/meephWM0hz/test_output_tot_pwr-0: 3.45s -/tmp/meepWcFBDI/test_point_defect_state-0 +/tmp/meephWM0hz/test_point_defect_state-0 ======================== Initializing eigensolver data Computing 50 bands with 1e-12 tolerance @@ -65034,7 +65061,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.031253814697265625 +elapsed time for initialization: 0.03040909767150879 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8, tm band 9, tm band 10, tm band 11, tm band 12, tm band 13, tm band 14, tm band 15, tm band 16, tm band 17, tm band 18, tm band 19, tm band 20, tm band 21, tm band 22, tm band 23, tm band 24, tm band 25, tm band 26, tm band 27, tm band 28, tm band 29, tm band 30, tm band 31, tm band 32, tm band 33, tm band 34, tm band 35, tm band 36, tm band 37, tm band 38, tm band 39, tm band 40, tm band 41, tm band 42, tm band 43, tm band 44, tm band 45, tm band 46, tm band 47, tm band 48, tm band 49, tm band 50 Solving for bands 1 to 10... @@ -65873,11 +65900,11 @@ Finished solving for bands 41 to 50 after 65 iterations. Finished k-point with 80 mean iterations/band. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.0904454, 0.0904609, 0.0904609, 0.0944816, 0.190067, 0.190067, 0.190067, 0.190068, 0.19007, 0.190245, 0.190245, 0.203237, 0.237196, 0.237298, 0.237298, 0.240872, 0.246066, 0.246066, 0.246066, 0.257408, 0.267453, 0.26748, 0.26748, 0.279812, 0.3773, 0.423294, 0.423305, 0.426098, 0.426099, 0.460406, 0.460406, 0.460407, 0.460423, 0.460426, 0.46271, 0.462711, 0.465484, 0.465538, 0.469456, 0.469457, 0.469856, 0.474575, 0.480164, 0.480164, 0.490505, 0.499359, 0.49936, 0.511689, 0.51273, 0.51273 -elapsed time for k point: 36.755298376083374 -total elapsed time for run: 36.78668522834778 +elapsed time for k point: 39.22390365600586 +total elapsed time for run: 39.25445604324341 done Fixing e-field (band 25) phase by -0.24413 + -0.969742i; max ampl. = 0.816569 -Outputting fields to /tmp/meepWcFBDI/test_point_defect_state-0-e.k01.b25.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_point_defect_state-0-e.k01.b25.z.tm.h5... Fixing d-field (band 25) phase by -1 + 2.78381e-07i; max ampl. = 3.30563 D-energy-components:, 1, 25, 0, 0, 1 Initializing eigensolver data @@ -65957,7 +65984,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.019650936126708984 +elapsed time for initialization: 0.023072004318237305 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -66331,8 +66358,8 @@ iteration 159: trace = 0.0004139236165391841 (6.1302e-07% change) Finished solving for bands 1 to 1 after 159 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.3773 -elapsed time for k point: 0.766284704208374 -total elapsed time for run: 0.7860107421875 +elapsed time for k point: 1.0456602573394775 +total elapsed time for run: 1.068812608718872 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -66412,7 +66439,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.016468048095703125 +elapsed time for initialization: 0.02130413055419922 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -66786,8 +66813,8 @@ iteration 159: trace = 0.0004139236165391841 (6.1302e-07% change) Finished solving for bands 1 to 1 after 159 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.3773 -elapsed time for k point: 0.7750911712646484 -total elapsed time for run: 0.7916266918182373 +elapsed time for k point: 0.9587469100952148 +total elapsed time for run: 0.9801197052001953 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -66867,7 +66894,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.016757965087890625 +elapsed time for initialization: 0.017002582550048828 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -67312,8 +67339,8 @@ iteration 187: trace = 0.001795102514608297 (4.93458e-07% change) Finished solving for bands 1 to 1 after 187 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.282209 -elapsed time for k point: 0.9038629531860352 -total elapsed time for run: 0.9206840991973877 +elapsed time for k point: 0.9385044574737549 +total elapsed time for run: 0.9555706977844238 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -67393,7 +67420,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.016923904418945312 +elapsed time for initialization: 0.016798734664916992 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -67726,8 +67753,8 @@ iteration 144: trace = 0.0009724596426332791 (7.79278e-07% change) Finished solving for bands 1 to 1 after 144 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.301374 -elapsed time for k point: 0.703493595123291 -total elapsed time for run: 0.7204830646514893 +elapsed time for k point: 0.945411205291748 +total elapsed time for run: 0.9622800350189209 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -67807,7 +67834,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.01685190200805664 +elapsed time for initialization: 0.021561145782470703 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -68108,8 +68135,8 @@ iteration 130: trace = 0.0004433872992476794 (9.26878e-07% change) Finished solving for bands 1 to 1 after 130 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.317732 -elapsed time for k point: 0.6249010562896729 -total elapsed time for run: 0.6418190002441406 +elapsed time for k point: 0.8571577072143555 +total elapsed time for run: 0.8787879943847656 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -68189,7 +68216,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.016828298568725586 +elapsed time for initialization: 0.021603822708129883 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -68524,8 +68551,8 @@ iteration 142: trace = 0.0007053630328314599 (5.34147e-07% change) Finished solving for bands 1 to 1 after 142 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.308953 -elapsed time for k point: 0.6918275356292725 -total elapsed time for run: 0.7087254524230957 +elapsed time for k point: 0.7613441944122314 +total elapsed time for run: 0.7830138206481934 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -68605,7 +68632,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.01685643196105957 +elapsed time for initialization: 0.016712665557861328 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -68930,8 +68957,8 @@ iteration 139: trace = 0.0005431761082614576 (6.45213e-07% change) Finished solving for bands 1 to 1 after 139 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.314172 -elapsed time for k point: 0.6765849590301514 -total elapsed time for run: 0.6935157775878906 +elapsed time for k point: 0.697040319442749 +total elapsed time for run: 0.7138140201568604 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -69011,7 +69038,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.016806364059448242 +elapsed time for initialization: 0.017423391342163086 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -69335,8 +69362,8 @@ iteration 138: trace = 0.0006236677264374859 (9.3341e-07% change) Finished solving for bands 1 to 1 after 138 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.311508 -elapsed time for k point: 0.6658341884613037 -total elapsed time for run: 0.6827061176300049 +elapsed time for k point: 0.7143642902374268 +total elapsed time for run: 0.7318475246429443 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -69416,7 +69443,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.016810178756713867 +elapsed time for initialization: 0.016754865646362305 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -69740,8 +69767,8 @@ iteration 139: trace = 0.0005435712197209183 (7.00716e-07% change) Finished solving for bands 1 to 1 after 139 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.314159 -elapsed time for k point: 0.6769387722015381 -total elapsed time for run: 0.6938321590423584 +elapsed time for k point: 0.7154803276062012 +total elapsed time for run: 0.7322986125946045 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -69821,7 +69848,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.01678609848022461 +elapsed time for initialization: 0.016772031784057617 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -70139,8 +70166,8 @@ iteration 136: trace = 0.0005834221953899297 (7.83825e-07% change) Finished solving for bands 1 to 1 after 136 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.31282 -elapsed time for k point: 0.7829158306121826 -total elapsed time for run: 0.7997684478759766 +elapsed time for k point: 0.7085521221160889 +total elapsed time for run: 0.7253870964050293 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -70220,7 +70247,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.016758441925048828 +elapsed time for initialization: 0.016481637954711914 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -70544,8 +70571,8 @@ iteration 139: trace = 0.0005435714921653862 (7.00912e-07% change) Finished solving for bands 1 to 1 after 139 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.314159 -elapsed time for k point: 0.6695234775543213 -total elapsed time for run: 0.686347246170044 +elapsed time for k point: 0.7217776775360107 +total elapsed time for run: 0.7383198738098145 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -70625,7 +70652,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.016754627227783203 +elapsed time for initialization: 0.017487049102783203 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -70959,8 +70986,8 @@ iteration 145: trace = 0.0005634408794978012 (4.83408e-07% change) Finished solving for bands 1 to 1 after 145 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.313486 -elapsed time for k point: 0.7049455642700195 -total elapsed time for run: 0.721764087677002 +elapsed time for k point: 0.7341387271881104 +total elapsed time for run: 0.7516891956329346 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -71040,7 +71067,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.016773700714111328 +elapsed time for initialization: 0.01658034324645996 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -71364,8 +71391,8 @@ iteration 139: trace = 0.0005435714922125616 (7.00913e-07% change) Finished solving for bands 1 to 1 after 139 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.314159 -elapsed time for k point: 0.6694436073303223 -total elapsed time for run: 0.6862828731536865 +elapsed time for k point: 0.7051589488983154 +total elapsed time for run: 0.7218027114868164 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -71445,7 +71472,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.016689300537109375 +elapsed time for initialization: 0.016608715057373047 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... @@ -71769,12 +71796,12 @@ iteration 139: trace = 0.0005435714922125616 (7.00913e-07% change) Finished solving for bands 1 to 1 after 139 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.314159 -.elapsed time for k point: 0.6788768768310547 -total elapsed time for run: 0.6956307888031006 +.elapsed time for k point: 0.9212667942047119 +total elapsed time for run: 0.9379596710205078 done -/tmp/meepWcFBDI/test_point_defect_state-0: 47.03s +/tmp/meephWM0hz/test_point_defect_state-0: 50.96s -/tmp/meepWcFBDI/test_poynting-0 +/tmp/meephWM0hz/test_poynting-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -71817,7 +71844,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0023529529571533203 +elapsed time for initialization: 0.003258943557739258 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -71928,7 +71955,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.2019658088684082 +elapsed time for k point: 0.25980257987976074 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -72179,7 +72206,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6262619495391846 +elapsed time for k point: 0.8513586521148682 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72236,7 +72263,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13748669624328613 +elapsed time for k point: 0.20123672485351562 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72289,7 +72316,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.1272270679473877 +elapsed time for k point: 0.16294097900390625 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72350,7 +72377,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14818263053894043 +elapsed time for k point: 0.18181514739990234 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72435,7 +72462,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.21008896827697754 +elapsed time for k point: 0.2578253746032715 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -72506,7 +72533,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17360615730285645 +elapsed time for k point: 0.2145850658416748 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72567,7 +72594,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14832520484924316 +elapsed time for k point: 0.18166732788085938 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72620,7 +72647,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12752556800842285 +elapsed time for k point: 0.1587369441986084 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72672,7 +72699,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12225627899169922 +elapsed time for k point: 0.15068650245666504 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72724,15 +72751,15 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.1224050521850586 -Outputting fields to /tmp/meepWcFBDI/test_poynting-0-flux.v.k11.b01.te.h5... -Outputting fields to /tmp/meepWcFBDI/test_poynting-0-flux.v.k11.b02.te.h5... -Outputting fields to /tmp/meepWcFBDI/test_poynting-0-flux.v.k11.b03.te.h5... -Outputting fields to /tmp/meepWcFBDI/test_poynting-0-flux.v.k11.b04.te.h5... -Outputting fields to /tmp/meepWcFBDI/test_poynting-0-flux.v.k11.b05.te.h5... -Outputting fields to /tmp/meepWcFBDI/test_poynting-0-flux.v.k11.b06.te.h5... -Outputting fields to /tmp/meepWcFBDI/test_poynting-0-flux.v.k11.b07.te.h5... -Outputting fields to /tmp/meepWcFBDI/test_poynting-0-flux.v.k11.b08.te.h5... +elapsed time for k point: 0.1500251293182373 +Outputting fields to /tmp/meephWM0hz/test_poynting-0-flux.v.k11.b01.te.h5... +Outputting fields to /tmp/meephWM0hz/test_poynting-0-flux.v.k11.b02.te.h5... +Outputting fields to /tmp/meephWM0hz/test_poynting-0-flux.v.k11.b03.te.h5... +Outputting fields to /tmp/meephWM0hz/test_poynting-0-flux.v.k11.b04.te.h5... +Outputting fields to /tmp/meephWM0hz/test_poynting-0-flux.v.k11.b05.te.h5... +Outputting fields to /tmp/meephWM0hz/test_poynting-0-flux.v.k11.b06.te.h5... +Outputting fields to /tmp/meephWM0hz/test_poynting-0-flux.v.k11.b07.te.h5... +Outputting fields to /tmp/meephWM0hz/test_poynting-0-flux.v.k11.b08.te.h5... solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72773,7 +72800,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09601449966430664 +elapsed time for k point: 0.10887742042541504 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72820,7 +72847,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11153626441955566 +elapsed time for k point: 0.11071181297302246 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72883,7 +72910,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15216851234436035 +elapsed time for k point: 0.15160894393920898 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -72956,7 +72983,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17808246612548828 +elapsed time for k point: 0.1758100986480713 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -73151,7 +73178,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -..elapsed time for k point: 0.355942964553833 +..elapsed time for k point: 0.35832691192626953 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -73163,15 +73190,15 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.1425158977508545 +total elapsed time for run: 3.816679000854492 done -/tmp/meepWcFBDI/test_poynting-0: 3.31s +/tmp/meephWM0hz/test_poynting-0: 3.83s -/tmp/meepWcFBDI/test_resolution-0 +/tmp/meephWM0hz/test_resolution-0 ======================== -/tmp/meepWcFBDI/test_resolution-0: 0.00s +/tmp/meephWM0hz/test_resolution-0: 0.00s -/tmp/meepWcFBDI/test_run_te-0 +/tmp/meephWM0hz/test_run_te-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -73214,7 +73241,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002390146255493164 +elapsed time for initialization: 0.002465486526489258 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -73325,7 +73352,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20125126838684082 +elapsed time for k point: 0.19933438301086426 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -73576,7 +73603,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6279854774475098 +elapsed time for k point: 0.6177549362182617 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -73633,7 +73660,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.1388392448425293 +elapsed time for k point: 0.13609528541564941 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -73686,7 +73713,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12738037109375 +elapsed time for k point: 0.12616944313049316 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -73747,7 +73774,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14741897583007812 +elapsed time for k point: 0.14590787887573242 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -73832,7 +73859,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.2093191146850586 +elapsed time for k point: 0.20578980445861816 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -73903,7 +73930,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.1731860637664795 +elapsed time for k point: 0.1712779998779297 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -73964,7 +73991,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.1471703052520752 +elapsed time for k point: 0.1452655792236328 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -74017,7 +74044,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.1272881031036377 +elapsed time for k point: 0.12513518333435059 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -74069,7 +74096,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12244105339050293 +elapsed time for k point: 0.12059807777404785 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -74121,7 +74148,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.1214451789855957 +elapsed time for k point: 0.19390225410461426 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -74162,7 +74189,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09601378440856934 +elapsed time for k point: 0.09497499465942383 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -74209,7 +74236,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.1124715805053711 +elapsed time for k point: 0.1179347038269043 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -74272,7 +74299,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15322232246398926 +elapsed time for k point: 0.15227603912353516 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -74345,7 +74372,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17859315872192383 +elapsed time for k point: 0.17650127410888672 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -74540,7 +74567,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -.elapsed time for k point: 0.35910630226135254 +.elapsed time for k point: 0.35501575469970703 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -74552,11 +74579,11 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.04656982421875 +total elapsed time for run: 3.087475061416626 done -/tmp/meepWcFBDI/test_run_te-0: 3.05s +/tmp/meephWM0hz/test_run_te-0: 3.09s -/tmp/meepWcFBDI/test_run_te_no_geometry-0 +/tmp/meephWM0hz/test_run_te_no_geometry-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-07 tolerance @@ -74597,7 +74624,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0010542869567871094 +elapsed time for initialization: 0.0011186599731445312 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -74620,7 +74647,7 @@ iteration 8: trace = 10.00000000175005 (4.04653e-07% change) Finished solving for bands 2 to 8 after 8 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 1, 1, 1, 1, 1.41421, 1.41421, 1.41421 -elapsed time for k point: 0.033797264099121094 +elapsed time for k point: 0.033075809478759766 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... near maximum in trace @@ -74630,35 +74657,35 @@ iteration 2: trace = 9.880000004055374 (1.30806e-06% change) Finished solving for bands 1 to 8 after 2 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.1, 0.9, 1.00499, 1.00499, 1.1, 1.34536, 1.34536, 1.48661 -elapsed time for k point: 0.014346837997436523 +elapsed time for k point: 0.013801336288452148 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. iteration 1: trace = 9.920000000339343 (3.76491e-08% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.2, 0.8, 1.0198, 1.0198, 1.2, 1.28062, 1.28062, 1.56205 -elapsed time for k point: 0.008744478225708008 +elapsed time for k point: 0.008636951446533203 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. iteration 1: trace = 10.12000000005403 (2.56724e-09% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.3, 0.7, 1.04403, 1.04403, 1.22066, 1.22066, 1.3, 1.64012 -elapsed time for k point: 0.00899648666381836 +elapsed time for k point: 0.008568286895751953 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. iteration 1: trace = 10.4800000000071 (3.43847e-10% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.4, 0.6, 1.07703, 1.07703, 1.16619, 1.16619, 1.4, 1.72047 -elapsed time for k point: 0.008762598037719727 +elapsed time for k point: 0.008640050888061523 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. iteration 1: trace = 10.99999999989866 (8.98061e-10% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.5, 0.5, 1.11803, 1.11803, 1.11803, 1.11803, 1.5, 1.80278 -elapsed time for k point: 0.008820772171020508 +elapsed time for k point: 0.00865483283996582 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... near maximum in trace @@ -74668,7 +74695,7 @@ iteration 2: trace = 10.87999995545266 (4.05901e-06% change) Finished solving for bands 1 to 8 after 2 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.509902, 0.509902, 1.02956, 1.02956, 1.2083, 1.2083, 1.50333, 1.74929 -elapsed time for k point: 0.013854503631591797 +elapsed time for k point: 0.013789892196655273 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... near maximum in trace @@ -74678,7 +74705,7 @@ iteration 2: trace = 10.72763986654908 (7.95051e-07% change) Finished solving for bands 1 to 8 after 2 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.538516, 0.566775, 0.956971, 0.9598, 1.3061, 1.30974, 1.52004, 1.59611 -elapsed time for k point: 0.013878583908081055 +elapsed time for k point: 0.013669490814208984 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -74699,21 +74726,21 @@ iteration 8: trace = 10.7200001769306 (3.99177e-06% change) Finished solving for bands 1 to 8 after 8 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.583095, 0.583095, 0.860233, 0.860233, 1.39284, 1.39284, 1.52971, 1.52971 -elapsed time for k point: 0.04447674751281738 +elapsed time for k point: 0.04388594627380371 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. iteration 1: trace = 11.28000006011032 (3.51788e-07% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.640312, 0.640312, 0.781025, 0.781025, 1.48661, 1.48661, 1.55242, 1.55242 -elapsed time for k point: 0.008756160736083984 +elapsed time for k point: 0.008640766143798828 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. iteration 1: trace = 12.00000000012884 (4.02124e-08% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.707107, 0.707107, 0.707107, 0.707107, 1.58114, 1.58114, 1.58114, 1.58114 -elapsed time for k point: 0.008714914321899414 +elapsed time for k point: 0.00858163833618164 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... near maximum in trace @@ -74875,35 +74902,35 @@ iteration 77: trace = 10.96000007994671 (2.13035e-06% change) Finished solving for bands 1 to 8 after 77 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.565685, 0.72111, 0.72111, 0.848528, 1.45602, 1.45602, 1.52315, 1.52315 -elapsed time for k point: 0.397308349609375 +elapsed time for k point: 0.39098620414733887 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. iteration 1: trace = 10.24000001500887 (1.09258e-06% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.424264, 0.761577, 0.761577, 0.989949, 1.33417, 1.33417, 1.47648, 1.47648 -elapsed time for k point: 0.008774995803833008 +elapsed time for k point: 0.008646488189697266 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. iteration 1: trace = 9.840000001756968 (1.78163e-07% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.282843, 0.824621, 0.824621, 1.13137, 1.21655, 1.21655, 1.44222, 1.44222 -elapsed time for k point: 0.008746623992919922 +elapsed time for k point: 0.00889730453491211 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 1 iterations. iteration 1: trace = 9.760000000165835 (2.02392e-08% change) Finished solving for bands 1 to 8 after 1 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.141421, 0.905539, 0.905539, 1.10454, 1.10454, 1.27279, 1.42127, 1.42127 -elapsed time for k point: 0.008728504180908203 +elapsed time for k point: 0.008650541305541992 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 1 iterations. iteration 1: trace = 10.00000000001522 (1.76501e-09% change) Finished solving for bands 2 to 8 after 1 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 1, 1, 1, 1, 1.41421, 1.41421, 1.41421 -.elapsed time for k point: 0.006604433059692383 +.elapsed time for k point: 0.006935596466064453 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.7071067811865476 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.5000000000350684 at Vector3<0.5, 0.0, 0.0> to 1.0000000000464655 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.7071067811884203 at Vector3<0.5, 0.5, 0.0> to 1.1180339887555262 at Vector3<0.5, 0.0, 0.0> @@ -74912,11 +74939,11 @@ Band 6 range: 1.118033988768711 at Vector3<0.5, 0.0, 0.0> to 1.581138830085848 at Vector3<0.5, 0.5, 0.0> Band 7 range: 1.2806248475164026 at Vector3<0.2, 0.0, 0.0> to 1.5811388300892417 at Vector3<0.5, 0.5, 0.0> Band 8 range: 1.414213562375283 at Vector3<0.0, 0.0, 0.0> to 1.8027756376524438 at Vector3<0.5, 0.0, 0.0> -total elapsed time for run: 0.604964017868042 +total elapsed time for run: 0.5957190990447998 done -/tmp/meepWcFBDI/test_run_te_no_geometry-0: 0.61s +/tmp/meephWM0hz/test_run_te_no_geometry-0: 0.60s -/tmp/meepWcFBDI/test_run_te_with_mu_material-0 +/tmp/meephWM0hz/test_run_te_with_mu_material-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -74960,7 +74987,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0041391849517822266 +elapsed time for initialization: 0.00421905517578125 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -75378,7 +75405,7 @@ iteration 204: trace = 6.854300770958573 (9.18072e-11% change) Finished solving for bands 2 to 8 after 204 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.669987, 0.783178, 0.78318, 0.965522, 1.18154, 1.18154, 1.20597 -elapsed time for k point: 1.3459975719451904 +elapsed time for k point: 1.3320441246032715 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -75767,7 +75794,7 @@ iteration 162: trace = 6.791967496013989 (8.76413e-11% change) Finished solving for bands 1 to 8 after 162 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0813996, 0.654814, 0.784954, 0.787051, 0.973107, 1.147, 1.15475, 1.23489 -elapsed time for k point: 1.502415418624878 +elapsed time for k point: 1.474503755569458 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -76019,7 +76046,7 @@ iteration 108: trace = 6.760812143847753 (4.43642e-11% change) Finished solving for bands 1 to 8 after 108 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.161634, 0.615231, 0.789764, 0.798457, 0.982219, 1.11674, 1.12242, 1.27406 -elapsed time for k point: 1.0035793781280518 +elapsed time for k point: 0.9885337352752686 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -76239,7 +76266,7 @@ iteration 98: trace = 6.801884535685708 (8.92111e-11% change) Finished solving for bands 1 to 8 after 98 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.238847, 0.561888, 0.796082, 0.816438, 0.967926, 1.09564, 1.12526, 1.31351 -elapsed time for k point: 0.9105768203735352 +elapsed time for k point: 0.8932998180389404 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -76807,7 +76834,7 @@ iteration 272: trace = 6.680068177074701 (6.7929e-11% change) Finished solving for bands 1 to 8 after 272 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.307852, 0.505558, 0.80155, 0.837884, 0.938877, 1.07767, 1.16248, 1.26133 -elapsed time for k point: 2.7793397903442383 +elapsed time for k point: 2.464738130569458 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -76968,7 +76995,7 @@ iteration 77: trace = 6.642769244577109 (8.4315e-11% change) Finished solving for bands 1 to 8 after 77 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.344122, 0.473282, 0.803737, 0.850595, 0.922321, 1.07128, 1.20345, 1.21829 -elapsed time for k point: 0.7154698371887207 +elapsed time for k point: 0.7020702362060547 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -77152,7 +77179,7 @@ iteration 87: trace = 6.663505677515148 (7.55754e-11% change) Finished solving for bands 1 to 8 after 87 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.349806, 0.482366, 0.768987, 0.886345, 0.90475, 1.06612, 1.21866, 1.22114 -elapsed time for k point: 0.8076388835906982 +elapsed time for k point: 0.7943456172943115 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -77364,7 +77391,7 @@ iteration 102: trace = 6.70884562169679 (9.42214e-11% change) Finished solving for bands 1 to 8 after 102 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.365505, 0.508431, 0.720714, 0.859475, 0.938003, 1.05964, 1.21894, 1.25305 -elapsed time for k point: 0.9468019008636475 +elapsed time for k point: 0.9361791610717773 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -77618,7 +77645,7 @@ iteration 123: trace = 6.740400274230594 (7.87454e-11% change) Finished solving for bands 1 to 8 after 123 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.387171, 0.548256, 0.676549, 0.800668, 0.989113, 1.05673, 1.21445, 1.27327 -elapsed time for k point: 1.2354846000671387 +elapsed time for k point: 1.1205344200134277 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -78308,7 +78335,7 @@ iteration 331: trace = 6.638733455481888 (6.51946e-11% change) Finished solving for bands 1 to 8 after 331 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.407624, 0.596325, 0.643243, 0.739976, 1.03397, 1.05588, 1.19281, 1.24454 -elapsed time for k point: 3.4262287616729736 +elapsed time for k point: 3.0320205688476562 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -78453,7 +78480,7 @@ iteration 69: trace = 6.611072637361749 (7.41327e-11% change) Finished solving for bands 1 to 8 after 69 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.416529, 0.630179, 0.63018, 0.701793, 1.05575, 1.05575, 1.17509, 1.24128 -elapsed time for k point: 0.7539670467376709 +elapsed time for k point: 0.6311037540435791 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -78656,7 +78683,7 @@ iteration 97: trace = 6.660936714455418 (7.90048e-11% change) Finished solving for bands 1 to 8 after 97 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.39535, 0.591668, 0.641198, 0.766761, 1.02252, 1.04927, 1.20755, 1.24532 -elapsed time for k point: 0.9272246360778809 +elapsed time for k point: 0.8819084167480469 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -78926,7 +78953,7 @@ iteration 127: trace = 6.720498465556362 (4.4181e-11% change) Finished solving for bands 1 to 8 after 127 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.326025, 0.580731, 0.672069, 0.852808, 0.974388, 1.03211, 1.23516, 1.24808 -elapsed time for k point: 1.2483248710632324 +elapsed time for k point: 1.1527960300445557 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -79173,7 +79200,7 @@ iteration 109: trace = 6.712756811033316 (8.35021e-11% change) Finished solving for bands 1 to 8 after 109 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.226064, 0.606225, 0.716276, 0.861027, 1.00531, 1.00779, 1.22714, 1.22782 -elapsed time for k point: 1.0399651527404785 +elapsed time for k point: 0.9912052154541016 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -79478,7 +79505,7 @@ iteration 126: trace = 6.74681761816284 (8.67534e-11% change) Finished solving for bands 1 to 8 after 126 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.114855, 0.645572, 0.76138, 0.812, 0.980404, 1.09879, 1.19545, 1.21663 -elapsed time for k point: 1.2232921123504639 +elapsed time for k point: 1.1534008979797363 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 3 iterations. @@ -79750,7 +79777,7 @@ iteration 132: trace = 6.854300770959932 (9.87657e-11% change) Finished solving for bands 2 to 8 after 132 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.669987, 0.783178, 0.78318, 0.965522, 1.18154, 1.18154, 1.20597 -elapsed time for k point: 0.8947281837463379 +elapsed time for k point: 0.8584818840026855 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.41652912330374914 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.47328232348733495 at Vector3<0.5, 0.0, 0.0> to 0.6699867281290623 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.6301802646818522 at Vector3<0.5, 0.5, 0.0> to 0.8037365323031509 at Vector3<0.5, 0.0, 0.0> @@ -79761,14 +79788,14 @@ Band 8 range: 1.2059728636717657 at Vector3<0.0, 0.0, 0.0> to 1.3135062523646435 at Vector3<0.30000000000000004, 0.0, 0.0> Gap from band 1 (0.41652912330374914) to band 2 (0.47328232348733495), 12.756230634760696% Gap from band 4 (0.886344816771213) to band 5 (0.9047498485811121), 2.0551713056750813% -total elapsed time for run: 20.766237258911133 +total elapsed time for run: 19.412410974502563 done mu: 1-5, mean 1.50265, harm. mean 1.12084, 14.5508% > 1, 12.5663% "fill" -Outputting /tmp/meepWcFBDI/test_run_te_with_mu_material-0-mu.h5... +Outputting /tmp/meephWM0hz/test_run_te_with_mu_material-0-mu.h5... mu: 1-5, mean 1.50265, harm. mean 1.12084, 14.5508% > 1, 12.5663% "fill" -./tmp/meepWcFBDI/test_run_te_with_mu_material-0: 21.14s +./tmp/meephWM0hz/test_run_te_with_mu_material-0: 19.42s -/tmp/meepWcFBDI/test_run_tm-0 +/tmp/meephWM0hz/test_run_tm-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -79811,7 +79838,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0023915767669677734 +elapsed time for initialization: 0.002408742904663086 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8 Solving for bands 2 to 8... @@ -79947,7 +79974,7 @@ iteration 61: trace = 4.373720851032935 (3.72636e-11% change) Finished solving for bands 2 to 8 after 61 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.546027, 0.552094, 0.552096, 0.812093, 0.854314, 0.951107, 1.08259 -elapsed time for k point: 0.24231410026550293 +elapsed time for k point: 0.23593378067016602 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -79998,7 +80025,7 @@ iteration 23: trace = 4.290857263081674 (9.18222e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tmfreqs:, 2, 0.1, 0, 0, 0.1, 0.0643671, 0.518896, 0.552617, 0.579095, 0.812721, 0.852958, 0.941428, 1.04995 -elapsed time for k point: 0.12205982208251953 +elapsed time for k point: 0.12051272392272949 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -80029,7 +80056,7 @@ iteration 13: trace = 4.208307958519126 (3.87705e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 3, 0.2, 0, 0, 0.2, 0.126061, 0.48795, 0.553991, 0.610359, 0.812384, 0.849484, 0.912816, 1.02959 -elapsed time for k point: 0.07036566734313965 +elapsed time for k point: 0.06934738159179688 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -80060,7 +80087,7 @@ iteration 13: trace = 4.150444015828809 (1.03146e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 4, 0.3, 0, 0, 0.3, 0.181523, 0.45665, 0.555709, 0.644685, 0.802314, 0.845326, 0.880698, 1.025 -elapsed time for k point: 0.07036566734313965 +elapsed time for k point: 0.06953263282775879 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -80091,7 +80118,7 @@ iteration 13: trace = 4.119598598621692 (1.07152e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 5, 0.4, 0, 0, 0.4, 0.224302, 0.429317, 0.557116, 0.682524, 0.772176, 0.842059, 0.865404, 1.0269 -elapsed time for k point: 0.07050228118896484 +elapsed time for k point: 0.06918191909790039 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -80122,7 +80149,7 @@ iteration 13: trace = 4.110777242725125 (6.68925e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 6, 0.5, 0, 0, 0.5, 0.241821, 0.417114, 0.557658, 0.713395, 0.741311, 0.84083, 0.862516, 1.02856 -elapsed time for k point: 0.07036638259887695 +elapsed time for k point: 0.06923389434814453 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -80151,7 +80178,7 @@ iteration 12: trace = 4.0994899642748 (2.49804e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.245235, 0.4236, 0.551085, 0.711571, 0.749855, 0.841982, 0.862609, 1.01714 -elapsed time for k point: 0.06543231010437012 +elapsed time for k point: 0.06443428993225098 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -80178,7 +80205,7 @@ iteration 11: trace = 4.079452895803482 (8.21458e-11% change) Finished solving for bands 1 to 8 after 11 iterations. tmfreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.25442, 0.441321, 0.535034, 0.706018, 0.772267, 0.845818, 0.862861, 0.989395 -elapsed time for k point: 0.060064077377319336 +elapsed time for k point: 0.05926680564880371 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -80207,7 +80234,7 @@ iteration 12: trace = 4.068759276129136 (1.19842e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.266397, 0.465222, 0.516482, 0.697068, 0.802974, 0.853388, 0.863228, 0.954203 -elapsed time for k point: 0.06543684005737305 +elapsed time for k point: 0.06427764892578125 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -80240,7 +80267,7 @@ iteration 14: trace = 4.07552694934967 (2.61298e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.276774, 0.48701, 0.501823, 0.687264, 0.837704, 0.86397, 0.865932, 0.916273 -elapsed time for k point: 0.07553625106811523 +elapsed time for k point: 0.07453465461730957 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -80275,7 +80302,7 @@ iteration 15: trace = 4.092150433618252 (9.12672e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.280948, 0.496196, 0.496197, 0.682617, 0.859474, 0.878316, 0.878316, 0.879351 -elapsed time for k point: 0.08091616630554199 +elapsed time for k point: 0.07975053787231445 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -80312,7 +80339,7 @@ iteration 16: trace = 4.046652183676487 (2.11583e-11% change) Finished solving for bands 1 to 8 after 16 iterations. tmfreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.27141, 0.485365, 0.501693, 0.689111, 0.830636, 0.844978, 0.893706, 0.898991 -elapsed time for k point: 0.08927750587463379 +elapsed time for k point: 0.0844566822052002 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -80341,7 +80368,7 @@ iteration 12: trace = 4.044513236396849 (3.20398e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.236529, 0.473888, 0.515941, 0.679199, 0.819377, 0.829518, 0.897603, 0.933446 -elapsed time for k point: 0.06526064872741699 +elapsed time for k point: 0.0642695426940918 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -80370,7 +80397,7 @@ iteration 12: trace = 4.113415259755491 (2.54788e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.172884, 0.482973, 0.533242, 0.640233, 0.819202, 0.838111, 0.910409, 0.976551 -elapsed time for k point: 0.06534790992736816 +elapsed time for k point: 0.06458258628845215 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -80403,7 +80430,7 @@ iteration 14: trace = 4.240749642028247 (2.11115e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.0904174, 0.510404, 0.546943, 0.593803, 0.81373, 0.851132, 0.935551, 1.02882 -elapsed time for k point: 0.07585024833679199 +elapsed time for k point: 0.07478165626525879 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 4 iterations. @@ -80535,7 +80562,7 @@ iteration 59: trace = 4.373720851594641 (8.85798e-11% change) Finished solving for bands 2 to 8 after 59 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.546027, 0.552094, 0.552096, 0.812093, 0.854314, 0.951107, 1.08259 -.elapsed time for k point: 0.23038172721862793 +.elapsed time for k point: 0.22675728797912598 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.28094795352537405 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.41711424932466357 at Vector3<0.5, 0.0, 0.0> to 0.5460267793370319 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.4961974527654609 at Vector3<0.5, 0.5, 0.0> to 0.5576576362977237 at Vector3<0.5, 0.0, 0.0> @@ -80546,11 +80573,11 @@ Band 8 range: 0.8793510958294798 at Vector3<0.5, 0.5, 0.0> to 1.0825923841452598 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.28094795352537405) to band 2 (0.41711424932466357), 39.0126539564388% Gap from band 4 (0.7133951516423509) to band 5 (0.7413109657068664), 3.8380005049245294% -total elapsed time for run: 1.5228450298309326 +total elapsed time for run: 1.4940786361694336 done -/tmp/meepWcFBDI/test_run_tm-0: 1.53s +/tmp/meephWM0hz/test_run_tm-0: 1.49s -/tmp/meepWcFBDI/test_set_eigenvectors-0 +/tmp/meephWM0hz/test_set_eigenvectors-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -80593,7 +80620,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0024089813232421875 +elapsed time for initialization: 0.002351999282836914 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -80704,7 +80731,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20862293243408203 +elapsed time for k point: 0.20006799697875977 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -80955,7 +80982,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.628920316696167 +elapsed time for k point: 0.6202888488769531 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81012,7 +81039,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13721275329589844 +elapsed time for k point: 0.13576078414916992 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81065,7 +81092,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.1267390251159668 +elapsed time for k point: 0.1257026195526123 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81126,7 +81153,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.16158151626586914 +elapsed time for k point: 0.14519929885864258 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81211,7 +81238,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.209425687789917 +elapsed time for k point: 0.20907878875732422 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -81282,7 +81309,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17249321937561035 +elapsed time for k point: 0.17037272453308105 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81343,7 +81370,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14690327644348145 +elapsed time for k point: 0.14526033401489258 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81396,7 +81423,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12659049034118652 +elapsed time for k point: 0.12572026252746582 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81448,7 +81475,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12142109870910645 +elapsed time for k point: 0.12001895904541016 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81500,7 +81527,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12098503112792969 +elapsed time for k point: 0.11981892585754395 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81541,7 +81568,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09581232070922852 +elapsed time for k point: 0.09474539756774902 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81588,7 +81615,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11133837699890137 +elapsed time for k point: 0.11009430885314941 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81651,7 +81678,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.15271735191345215 +elapsed time for k point: 0.15042901039123535 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -81724,7 +81751,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17797589302062988 +elapsed time for k point: 0.21561074256896973 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -81919,7 +81946,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.36348676681518555 +elapsed time for k point: 0.35517001152038574 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -81931,7 +81958,7 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.0656163692474365 +total elapsed time for run: 3.046701431274414 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -81973,7 +82000,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002275228500366211 +elapsed time for initialization: 0.0022535324096679688 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -82084,7 +82111,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.20215201377868652 +elapsed time for k point: 0.19966816902160645 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -82335,7 +82362,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6315097808837891 +elapsed time for k point: 0.6203327178955078 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -82392,7 +82419,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13707542419433594 +elapsed time for k point: 0.13582825660705566 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -82445,7 +82472,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12901926040649414 +elapsed time for k point: 0.12514328956604004 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -82506,7 +82533,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.1467592716217041 +elapsed time for k point: 0.145890474319458 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -82591,7 +82618,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.20958471298217773 +elapsed time for k point: 0.20776772499084473 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -82662,7 +82689,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.1841421127319336 +elapsed time for k point: 0.1714155673980713 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -82723,7 +82750,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14675617218017578 +elapsed time for k point: 0.14617061614990234 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -82776,7 +82803,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.1264634132385254 +elapsed time for k point: 0.12573480606079102 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -82828,7 +82855,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12136554718017578 +elapsed time for k point: 0.12048196792602539 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -82880,7 +82907,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12092828750610352 +elapsed time for k point: 0.11952567100524902 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -82921,7 +82948,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.10147237777709961 +elapsed time for k point: 0.0951240062713623 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -82968,7 +82995,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.1115415096282959 +elapsed time for k point: 0.1100766658782959 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -83031,7 +83058,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.17727351188659668 +elapsed time for k point: 0.15073847770690918 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -83104,7 +83131,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17775964736938477 +elapsed time for k point: 0.17976665496826172 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -83299,7 +83326,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.3557460308074951 +elapsed time for k point: 0.3537936210632324 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -83311,7 +83338,7 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.0828402042388916 +total elapsed time for run: 3.0107574462890625 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -83353,7 +83380,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0023179054260253906 +elapsed time for initialization: 0.0022933483123779297 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -83464,7 +83491,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.2019634246826172 +elapsed time for k point: 0.2023630142211914 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -83715,7 +83742,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6512796878814697 +elapsed time for k point: 0.617283821105957 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -83772,7 +83799,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.13809418678283691 +elapsed time for k point: 0.13579440116882324 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -83825,7 +83852,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.12924909591674805 +elapsed time for k point: 0.12526965141296387 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -83886,7 +83913,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14778542518615723 +elapsed time for k point: 0.14561223983764648 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -83971,7 +83998,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.21044611930847168 +elapsed time for k point: 0.20721149444580078 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -84042,7 +84069,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17278337478637695 +elapsed time for k point: 0.17067337036132812 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -84103,7 +84130,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.1472618579864502 +elapsed time for k point: 0.14564824104309082 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -84156,7 +84183,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.12744855880737305 +elapsed time for k point: 0.12518858909606934 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -84208,7 +84235,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12169981002807617 +elapsed time for k point: 0.11990857124328613 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -84260,7 +84287,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12149953842163086 +elapsed time for k point: 0.1196603775024414 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -84301,7 +84328,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09635257720947266 +elapsed time for k point: 0.09480547904968262 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -84348,7 +84375,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11158919334411621 +elapsed time for k point: 0.11017274856567383 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -84411,7 +84438,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.1688060760498047 +elapsed time for k point: 0.15088915824890137 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -84484,7 +84511,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.1784648895263672 +elapsed time for k point: 0.17486977577209473 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -84679,7 +84706,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -.elapsed time for k point: 0.3687310218811035 +.elapsed time for k point: 0.35306715965270996 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -84691,11 +84718,11 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.09682035446167 +total elapsed time for run: 3.0017454624176025 done -/tmp/meepWcFBDI/test_set_eigenvectors-0: 9.25s +/tmp/meephWM0hz/test_set_eigenvectors-0: 9.06s -/tmp/meepWcFBDI/test_sq_rods-0 +/tmp/meephWM0hz/test_sq_rods-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -84738,7 +84765,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0023779869079589844 +elapsed time for initialization: 0.003086090087890625 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -84837,7 +84864,7 @@ iteration 46: trace = 5.62886416901309 (5.90292e-11% change) Finished solving for bands 2 to 8 after 46 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.561945, 0.780843, 0.780846, 0.924372, 1.00804, 1.00804, 1.09859 -elapsed time for k point: 0.19340944290161133 +elapsed time for k point: 0.23659205436706543 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -85116,7 +85143,7 @@ iteration 134: trace = 5.63851519575992 (7.1262e-11% change) Finished solving for bands 1 to 8 after 134 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897998, 0.56021, 0.767785, 0.782438, 0.912603, 1.00889, 1.00949, 1.11586 -elapsed time for k point: 0.7303645610809326 +elapsed time for k point: 0.896453857421875 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -85175,7 +85202,7 @@ iteration 27: trace = 5.595179271816549 (4.71775e-11% change) Finished solving for bands 1 to 8 after 27 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178853, 0.553301, 0.732522, 0.786672, 0.890463, 1.01386, 1.02078, 1.11301 -elapsed time for k point: 0.15740609169006348 +elapsed time for k point: 0.18108391761779785 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -85224,7 +85251,7 @@ iteration 22: trace = 5.577903304673048 (5.968e-11% change) Finished solving for bands 1 to 8 after 22 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.266124, 0.534865, 0.689376, 0.79205, 0.872926, 1.0209, 1.04285, 1.10753 -elapsed time for k point: 0.16924571990966797 +elapsed time for k point: 0.13321971893310547 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -85283,7 +85310,7 @@ iteration 27: trace = 5.594031416858376 (7.94021e-11% change) Finished solving for bands 1 to 8 after 27 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.349588, 0.49478, 0.658508, 0.796524, 0.862684, 1.02898, 1.07044, 1.10003 -elapsed time for k point: 0.1433417797088623 +elapsed time for k point: 0.14518427848815918 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -85386,7 +85413,7 @@ iteration 48: trace = 5.637414337940055 (7.81609e-11% change) Finished solving for bands 1 to 8 after 48 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.413346, 0.444623, 0.648672, 0.798265, 0.859327, 1.03311, 1.0958, 1.09742 -elapsed time for k point: 0.26909852027893066 +elapsed time for k point: 0.24841952323913574 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -85457,7 +85484,7 @@ iteration 33: trace = 5.518941371312554 (7.7119e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.424298, 0.448983, 0.644549, 0.802551, 0.854853, 0.98984, 1.05831, 1.11679 -elapsed time for k point: 0.17287182807922363 +elapsed time for k point: 0.2140054702758789 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -85516,7 +85543,7 @@ iteration 27: trace = 5.342524465514547 (5.96993e-11% change) Finished solving for bands 1 to 8 after 27 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.455354, 0.461161, 0.63323, 0.814782, 0.834251, 0.934558, 1.01274, 1.12367 -elapsed time for k point: 0.1419367790222168 +elapsed time for k point: 0.18494319915771484 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -85567,7 +85594,7 @@ iteration 23: trace = 5.199556238067977 (9.54361e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.478427, 0.501912, 0.61745, 0.784489, 0.83371, 0.906541, 0.967734, 1.12636 -elapsed time for k point: 0.12270140647888184 +elapsed time for k point: 0.15801620483398438 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -85619,7 +85646,7 @@ iteration 23: trace = 5.110086770190959 (3.55439e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.495605, 0.556867, 0.601739, 0.720584, 0.858432, 0.897772, 0.926611, 1.12762 -elapsed time for k point: 0.12299609184265137 +elapsed time for k point: 0.15622663497924805 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -85669,7 +85696,7 @@ iteration 22: trace = 5.07982777007301 (8.14249e-11% change) Finished solving for bands 1 to 8 after 22 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.503606, 0.594344, 0.594357, 0.679389, 0.883665, 0.895782, 0.895787, 1.12801 -elapsed time for k point: 0.11737966537475586 +elapsed time for k point: 0.15009117126464844 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -85710,7 +85737,7 @@ iteration 18: trace = 5.139784911490274 (2.6802e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.474671, 0.549917, 0.608032, 0.745035, 0.848355, 0.895854, 0.945891, 1.12708 -elapsed time for k point: 0.09648942947387695 +elapsed time for k point: 0.12344908714294434 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -85755,7 +85782,7 @@ iteration 20: trace = 5.307924174329594 (7.09817e-11% change) Finished solving for bands 1 to 8 after 20 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.373254, 0.543225, 0.646251, 0.817389, 0.830457, 0.896516, 1.0176, 1.12198 -elapsed time for k point: 0.13374018669128418 +elapsed time for k point: 0.13732194900512695 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -85812,7 +85839,7 @@ iteration 26: trace = 5.515690777956149 (3.9967e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252369, 0.551073, 0.700804, 0.797552, 0.899586, 0.90339, 1.08791, 1.10099 -elapsed time for k point: 0.1374499797821045 +elapsed time for k point: 0.1778707504272461 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -85887,7 +85914,7 @@ iteration 35: trace = 5.620307970788174 (8.50993e-11% change) Finished solving for bands 1 to 8 after 35 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.12694, 0.558854, 0.755651, 0.785047, 0.909884, 0.968813, 1.04814, 1.11332 -elapsed time for k point: 0.18515276908874512 +elapsed time for k point: 0.23859477043151855 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -86065,7 +86092,7 @@ iteration 85: trace = 5.628864169011924 (5.70884e-11% change) Finished solving for bands 2 to 8 after 85 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.561945, 0.780843, 0.780846, 0.924372, 1.00804, 1.00804, 1.09859 -elapsed time for k point: 0.3365960121154785 +elapsed time for k point: 0.4613931179046631 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.503605801521903 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4446229134706742 at Vector3<0.5, 0.0, 0.0> to 0.5943440245519604 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5943566394470332 at Vector3<0.5, 0.5, 0.0> to 0.7808428121911946 at Vector3<0.0, 0.0, 0.0> @@ -86077,7 +86104,7 @@ Gap from band 2 (0.5943440245519604) to band 3 (0.5943566394470332), 0.0021224679105202745% Gap from band 4 (0.8173893719542902) to band 5 (0.8304573822339181), 1.586071064729037% Gap from band 7 (1.095802149222103) to band 8 (1.0974168095854049), 0.14724114587991183% -total elapsed time for run: 3.2336292266845703 +total elapsed time for run: 3.847142219543457 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -86119,7 +86146,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002241849899291992 +elapsed time for initialization: 0.0031282901763916016 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8 Solving for bands 2 to 8... @@ -86196,7 +86223,7 @@ iteration 35: trace = 4.483798274693359 (8.37112e-11% change) Finished solving for bands 2 to 8 after 35 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.550336, 0.561338, 0.56134, 0.822948, 0.868842, 0.965325, 1.08938 -elapsed time for k point: 0.24429869651794434 +elapsed time for k point: 0.19093823432922363 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -86255,7 +86282,7 @@ iteration 27: trace = 4.398155533647466 (5.75337e-11% change) Finished solving for bands 1 to 8 after 27 iterations. tmfreqs:, 2, 0.1, 0, 0, 0.1, 0.0651416, 0.525004, 0.561885, 0.586307, 0.823536, 0.867346, 0.954632, 1.05688 -elapsed time for k point: 0.14316415786743164 +elapsed time for k point: 0.20678448677062988 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -86286,7 +86313,7 @@ iteration 13: trace = 4.314465855715584 (1.70453e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 3, 0.2, 0, 0, 0.2, 0.127665, 0.49365, 0.563323, 0.617312, 0.822737, 0.86353, 0.924306, 1.03882 -elapsed time for k point: 0.07006597518920898 +elapsed time for k point: 0.09626102447509766 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -86317,7 +86344,7 @@ iteration 13: trace = 4.256363888498333 (1.19777e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 4, 0.3, 0, 0, 0.3, 0.184047, 0.461592, 0.565122, 0.651397, 0.810839, 0.858984, 0.892949, 1.03589 -elapsed time for k point: 0.06993746757507324 +elapsed time for k point: 0.09431934356689453 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -86348,7 +86375,7 @@ iteration 13: trace = 4.226095324429571 (1.06764e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 5, 0.4, 0, 0, 0.4, 0.227778, 0.433361, 0.566596, 0.689045, 0.778792, 0.855425, 0.879398, 1.03874 -elapsed time for k point: 0.07013344764709473 +elapsed time for k point: 0.09306216239929199 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -86381,7 +86408,7 @@ iteration 14: trace = 4.217772179352382 (6.65854e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 6, 0.5, 0, 0, 0.5, 0.245809, 0.420657, 0.567163, 0.720092, 0.747203, 0.85409, 0.877012, 1.0408 -elapsed time for k point: 0.07498621940612793 +elapsed time for k point: 0.09653782844543457 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -86408,7 +86435,7 @@ iteration 11: trace = 4.205423828027402 (3.80791e-11% change) Finished solving for bands 1 to 8 after 11 iterations. tmfreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.249299, 0.427308, 0.560221, 0.718025, 0.756122, 0.855013, 0.877106, 1.02917 -elapsed time for k point: 0.05990266799926758 +elapsed time for k point: 0.07764792442321777 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -86437,7 +86464,7 @@ iteration 12: trace = 4.182592281022644 (3.09396e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.258693, 0.445541, 0.543385, 0.711698, 0.77935, 0.858136, 0.877357, 1.00092 -elapsed time for k point: 0.06472396850585938 +elapsed time for k point: 0.08427071571350098 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -86466,7 +86493,7 @@ iteration 12: trace = 4.167811239279437 (1.56845e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.270963, 0.470322, 0.524053, 0.701396, 0.810963, 0.864394, 0.877683, 0.965108 -elapsed time for k point: 0.06536173820495605 +elapsed time for k point: 0.08419036865234375 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -86499,7 +86526,7 @@ iteration 14: trace = 4.169023318668043 (1.8769e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.281614, 0.493207, 0.508823, 0.689961, 0.846785, 0.874595, 0.878068, 0.926581 -elapsed time for k point: 0.07606363296508789 +elapsed time for k point: 0.09925413131713867 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -86534,7 +86561,7 @@ iteration 15: trace = 4.178672965088623 (1.77692e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.285906, 0.502981, 0.502983, 0.684476, 0.874359, 0.883317, 0.883317, 0.892993 -elapsed time for k point: 0.08176565170288086 +elapsed time for k point: 0.10407066345214844 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -86573,7 +86600,7 @@ iteration 17: trace = 4.141012578035554 (3.47034e-11% change) Finished solving for bands 1 to 8 after 17 iterations. tmfreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.276089, 0.491352, 0.508683, 0.69258, 0.839723, 0.856431, 0.907219, 0.907347 -elapsed time for k point: 0.09238743782043457 +elapsed time for k point: 0.11783361434936523 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -86602,7 +86629,7 @@ iteration 12: trace = 4.141330405700028 (2.95535e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.240239, 0.47923, 0.523499, 0.685362, 0.829266, 0.840451, 0.910791, 0.941595 -elapsed time for k point: 0.06637430191040039 +elapsed time for k point: 0.0847616195678711 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -86631,7 +86658,7 @@ iteration 12: trace = 4.213521375941404 (1.82125e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.17524, 0.488533, 0.541561, 0.64751, 0.83002, 0.850443, 0.922657, 0.983925 -elapsed time for k point: 0.06566143035888672 +elapsed time for k point: 0.08153152465820312 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -86662,7 +86689,7 @@ iteration 13: trace = 4.345426086018988 (7.15174e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.0915259, 0.516393, 0.555924, 0.601211, 0.824561, 0.86529, 0.948412, 1.03526 -elapsed time for k point: 0.07317161560058594 +elapsed time for k point: 0.08241844177246094 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 4 iterations. @@ -86795,7 +86822,7 @@ iteration 59: trace = 4.483798024156444 (6.1684e-11% change) Finished solving for bands 2 to 8 after 59 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.550336, 0.561338, 0.56134, 0.822948, 0.868842, 0.965325, 1.08938 -.elapsed time for k point: 0.2293388843536377 +.elapsed time for k point: 0.23932957649230957 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.28590577911965437 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4206573383997506 at Vector3<0.5, 0.0, 0.0> to 0.5503360754831278 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.5029830978365973 at Vector3<0.5, 0.5, 0.0> to 0.5671632878128113 at Vector3<0.5, 0.0, 0.0> @@ -86806,11 +86833,11 @@ Band 8 range: 0.8929933495598095 at Vector3<0.5, 0.5, 0.0> to 1.0893776820093315 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.28590577911965437) to band 2 (0.4206573383997506), 38.142822895477686% Gap from band 4 (0.7200918204563995) to band 5 (0.7472029910480829), 3.695395142014446% -total elapsed time for run: 1.5505616664886475 +total elapsed time for run: 1.8374803066253662 done -/tmp/meepWcFBDI/test_sq_rods-0: 4.79s +/tmp/meephWM0hz/test_sq_rods-0: 7.13s -/tmp/meepWcFBDI/test_strip-0 +/tmp/meephWM0hz/test_strip-0 ======================== Initializing eigensolver data Computing 4 bands with 1e-12 tolerance @@ -86852,7 +86879,7 @@ Vector3<2.42, 0.0, 0.0> Vector3<2.71, 0.0, 0.0> Vector3<3.0, 0.0, 0.0> -elapsed time for initialization: 0.007161855697631836 +elapsed time for initialization: 0.008964300155639648 solve_kpoint (0.1,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3, band 4 Solving for bands 1 to 4... @@ -86941,7 +86968,7 @@ iteration 41: trace = 0.2686493130629632 (8.20736e-11% change) Finished solving for bands 1 to 4 after 41 iterations. freqs:, 1, 0.1, 0, 0, 0.1, 0.0807582, 0.0855765, 0.3147, 0.394675 -elapsed time for k point: 0.3384861946105957 +elapsed time for k point: 0.84187912940979 zparity:, 1, 0.9918457643226338, -0.9993165778920644, 0.926395271368805, 0.7342879853873218 yparity:, 1, -0.9999999941669422, 0.9999999948774904, 0.9999993171459365, -0.9999903437920776 solve_kpoint (0.39,0,0): @@ -87008,7 +87035,7 @@ iteration 30: trace = 0.6068839394817217 (4.75274e-11% change) Finished solving for bands 1 to 4 after 30 iterations. freqs:, 2, 0.39, 0, 0, 0.39, 0.305867, 0.318873, 0.435494, 0.471163 -elapsed time for k point: 0.24349212646484375 +elapsed time for k point: 0.31072306632995605 zparity:, 2, 0.8497976290527695, -0.8562083115829556, 0.6135047144565172, 0.704049364345128 yparity:, 2, -0.9999999782411544, 0.9999997901628063, 1.0000058683416102, -0.9999353452620497 solve_kpoint (0.68,0,0): @@ -87081,7 +87108,7 @@ iteration 33: trace = 1.207704486916823 (5.61315e-11% change) Finished solving for bands 1 to 4 after 33 iterations. freqs:, 3, 0.68, 0, 0, 0.68, 0.506676, 0.511416, 0.580115, 0.594058 -elapsed time for k point: 0.2713487148284912 +elapsed time for k point: 0.3400607109069824 zparity:, 3, 0.643047109774545, -0.5132970564886054, 0.7493332279009369, -0.5174581392304315 yparity:, 3, -1.0000092437102872, 0.9999867307863184, -0.9999773484877517, 0.9999739527336196 solve_kpoint (0.97,0,0): @@ -87144,7 +87171,7 @@ iteration 28: trace = 1.883192742813694 (5.92255e-11% change) Finished solving for bands 1 to 4 after 28 iterations. freqs:, 4, 0.97, 0, 0, 0.97, 0.629793, 0.64279, 0.724022, 0.741057 -elapsed time for k point: 0.22591590881347656 +elapsed time for k point: 0.2909579277038574 zparity:, 4, 0.9505599456750937, -0.7953782494198476, 0.29095932960125614, -0.2599400191342861 yparity:, 4, -0.9999756485608148, 0.9999734198098761, -0.9999951573074101, 1.0000024021439402 solve_kpoint (1.26,0,0): @@ -87257,7 +87284,7 @@ iteration 53: trace = 2.604105949809354 (7.32445e-11% change) Finished solving for bands 1 to 4 after 53 iterations. freqs:, 5, 1.26, 0, 0, 1.26, 0.691833, 0.716391, 0.880207, 0.915146 -elapsed time for k point: 0.4244551658630371 +elapsed time for k point: 0.5222213268280029 zparity:, 5, 0.989433203646882, -0.9410345597949186, -0.9057097520505684, 0.12590511647804528 yparity:, 5, -0.9999341958043352, 0.9999920496325992, -0.9999957145770425, 1.0000214447210682 solve_kpoint (1.55,0,0): @@ -87322,7 +87349,7 @@ iteration 29: trace = 3.170970083323865 (9.72496e-11% change) Finished solving for bands 1 to 4 after 29 iterations. freqs:, 6, 1.55, 0, 0, 1.55, 0.750543, 0.778256, 0.948183, 1.0502 -elapsed time for k point: 0.23717093467712402 +elapsed time for k point: 0.2351667881011963 zparity:, 6, 0.9953267395060865, -0.9730766670052251, -0.9862479112205113, 0.7878496623745026 yparity:, 6, -0.9999079119736635, 0.9999964725102661, -1.0000003774904456, 1.0001762821190752 solve_kpoint (1.84,0,0): @@ -87395,7 +87422,7 @@ iteration 32: trace = 3.666115155387485 (3.64612e-11% change) Finished solving for bands 1 to 4 after 32 iterations. freqs:, 7, 1.84, 0, 0, 1.84, 0.811564, 0.839559, 1.01283, 1.12995 -elapsed time for k point: 0.28168749809265137 +elapsed time for k point: 0.25649356842041016 zparity:, 7, 0.9973241081199105, -0.9843536270515989, -0.9920656947487942, 0.9432892229296927 yparity:, 7, -0.9998843493066252, 0.9999987176029624, -1.000004228954917, 1.0002512952520046 solve_kpoint (2.13,0,0): @@ -87629,7 +87656,7 @@ iteration 111: trace = 4.142245065134231 (5.78718e-11% change) Finished solving for bands 1 to 4 after 111 iterations. freqs:, 8, 2.13, 0, 0, 2.13, 0.875475, 0.902606, 1.07764, 1.18313 -elapsed time for k point: 0.9087715148925781 +elapsed time for k point: 0.8715741634368896 zparity:, 8, 0.9982486290503901, -0.9895791223045428, -0.9942480254115191, -0.9858374395352655 yparity:, 8, -0.9998633636072632, 1.0000002772665169, -1.0000094946200577, -0.9998446077371536 solve_kpoint (2.42,0,0): @@ -87680,7 +87707,7 @@ iteration 22: trace = 4.658682156001962 (6.47067e-11% change) Finished solving for bands 1 to 4 after 22 iterations. freqs:, 9, 2.42, 0, 0, 2.42, 0.942027, 0.967822, 1.14317, 1.23602 -elapsed time for k point: 0.17832541465759277 +elapsed time for k point: 0.1762995719909668 zparity:, 9, 0.9987530861904854, -0.9924225574132964, -0.995415920790763, -0.9908510257238302 yparity:, 9, -0.9998459146893232, 1.0000015100368125, -1.0000160082784346, -0.9998409671135013 solve_kpoint (2.71,0,0): @@ -87719,7 +87746,7 @@ iteration 16: trace = 5.225821941816037 (8.95007e-11% change) Finished solving for bands 1 to 4 after 16 iterations. freqs:, 10, 2.71, 0, 0, 2.71, 1.01083, 1.03512, 1.20959, 1.29208 -elapsed time for k point: 0.13367414474487305 +elapsed time for k point: 0.12950754165649414 zparity:, 10, 0.9990584518844072, -0.9941385054596943, -0.9961444762112248, -0.9934909746545189 yparity:, 10, -0.9998332718977166, 1.0000025246212394, -1.000023092333594, -0.9998348121387619 solve_kpoint (3,0,0): @@ -87758,18 +87785,18 @@ iteration 16: trace = 5.844970311253999 (6.84562e-11% change) Finished solving for bands 1 to 4 after 16 iterations. freqs:, 11, 3, 0, 0, 3, 1.0815, 1.10429, 1.27693, 1.35105 -Felapsed time for k point: 0.13241982460021973 +Felapsed time for k point: 0.13054466247558594 zparity:, 11, 0.9992573509363838, -0.9952507980579904, -0.9966396089669461, -0.9950905165813236 yparity:, 11, -0.9998264814151185, 1.0000033584035104, -1.0000301573652741, -0.9998331550674222 Band 1 range: 0.08075820534047551 at Vector3<0.1, 0.0, 0.0> to 1.0814996932106404 at Vector3<3.0, 0.0, 0.0> Band 2 range: 0.08557653550125197 at Vector3<0.1, 0.0, 0.0> to 1.104285309790447 at Vector3<3.0, 0.0, 0.0> Band 3 range: 0.31469968003306087 at Vector3<0.1, 0.0, 0.0> to 1.2769288087738524 at Vector3<3.0, 0.0, 0.0> Band 4 range: 0.39467479434570146 at Vector3<0.1, 0.0, 0.0> to 1.3510497758201507 at Vector3<3.0, 0.0, 0.0> -total elapsed time for run: 3.3852014541625977 +total elapsed time for run: 4.116861820220947 done -/tmp/meepWcFBDI/test_strip-0: 3.44s +/tmp/meephWM0hz/test_strip-0: 5.44s -/tmp/meepWcFBDI/test_subpixel_averaging-0 +/tmp/meephWM0hz/test_subpixel_averaging-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -87812,7 +87839,7 @@ Vector3<0.19999999999999996, 0.19999999999999996, 0.0> Vector3<0.09999999999999998, 0.09999999999999998, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.002382516860961914 +elapsed time for initialization: 0.002363443374633789 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -87923,7 +87950,7 @@ iteration 52: trace = 5.548117725324874 (4.74016e-11% change) Finished solving for bands 2 to 8 after 52 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.26517319679260254 +elapsed time for k point: 0.20145153999328613 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -88174,7 +88201,7 @@ iteration 121: trace = 5.540497242579405 (3.79927e-11% change) Finished solving for bands 1 to 8 after 121 iterations. tefreqs:, 2, 0.1, 0, 0, 0.1, 0.0897332, 0.551138, 0.7616, 0.774682, 0.907199, 1.00188, 1.00357, 1.10209 -elapsed time for k point: 0.6260929107666016 +elapsed time for k point: 0.6164200305938721 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88231,7 +88258,7 @@ iteration 26: trace = 5.499374946276068 (6.759e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 3, 0.2, 0, 0, 0.2, 0.178692, 0.544896, 0.728534, 0.778528, 0.880244, 1.00699, 1.01696, 1.10027 -elapsed time for k point: 0.14211368560791016 +elapsed time for k point: 0.19048476219177246 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88284,7 +88311,7 @@ iteration 24: trace = 5.48545908008786 (6.15763e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 4, 0.3, 0, 0, 0.3, 0.265798, 0.528176, 0.685449, 0.783377, 0.860714, 1.01515, 1.03843, 1.09664 -elapsed time for k point: 0.13946986198425293 +elapsed time for k point: 0.12565016746520996 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88345,7 +88372,7 @@ iteration 28: trace = 5.504362091981045 (5.80892e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 5, 0.4, 0, 0, 0.4, 0.348956, 0.490738, 0.652797, 0.787382, 0.849999, 1.02443, 1.06441, 1.09121 -elapsed time for k point: 0.14898896217346191 +elapsed time for k point: 0.14498066902160645 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88430,7 +88457,7 @@ iteration 40: trace = 5.538866868600049 (9.99485e-11% change) Finished solving for bands 1 to 8 after 40 iterations. tefreqs:, 6, 0.5, 0, 0, 0.5, 0.412791, 0.441588, 0.641998, 0.788933, 0.846588, 1.02916, 1.08607, 1.08787 -elapsed time for k point: 0.20931267738342285 +elapsed time for k point: 0.2057170867919922 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -88501,7 +88528,7 @@ iteration 33: trace = 5.41979773295833 (8.29052e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 7, 0.5, 0.1, 0, 0.509902, 0.423741, 0.445781, 0.63823, 0.793147, 0.842943, 0.986523, 1.05018, 1.10383 -elapsed time for k point: 0.17610430717468262 +elapsed time for k point: 0.17073345184326172 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88562,7 +88589,7 @@ iteration 28: trace = 5.240853948733921 (3.70127e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 8, 0.5, 0.2, 0, 0.538516, 0.454781, 0.457434, 0.627898, 0.805254, 0.826101, 0.927945, 1.00456, 1.10879 -elapsed time for k point: 0.14748835563659668 +elapsed time for k point: 0.14522671699523926 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88615,7 +88642,7 @@ iteration 24: trace = 5.096544273410621 (7.59123e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 9, 0.5, 0.3, 0, 0.583095, 0.473767, 0.501279, 0.61358, 0.781467, 0.824181, 0.894949, 0.959051, 1.1107 -elapsed time for k point: 0.1289510726928711 +elapsed time for k point: 0.12523198127746582 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88667,7 +88694,7 @@ iteration 23: trace = 5.00643649634139 (6.08862e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 10, 0.5, 0.4, 0, 0.640312, 0.489649, 0.556045, 0.59957, 0.719611, 0.849247, 0.884337, 0.917168, 1.11162 -elapsed time for k point: 0.12384295463562012 +elapsed time for k point: 0.12014126777648926 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88719,7 +88746,7 @@ iteration 23: trace = 4.975984265381786 (5.44939e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 11, 0.5, 0.5, 0, 0.707107, 0.496836, 0.593141, 0.593154, 0.679169, 0.878684, 0.881977, 0.881982, 1.11192 -elapsed time for k point: 0.12214159965515137 +elapsed time for k point: 0.11951303482055664 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88760,7 +88787,7 @@ iteration 18: trace = 5.036378479895263 (5.47046e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tefreqs:, 12, 0.4, 0.4, 0, 0.565685, 0.470987, 0.546003, 0.606732, 0.743602, 0.839223, 0.882254, 0.93697, 1.11121 -elapsed time for k point: 0.09742999076843262 +elapsed time for k point: 0.09525775909423828 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88807,7 +88834,7 @@ iteration 21: trace = 5.206566305891691 (3.92012e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 13, 0.3, 0.3, 0, 0.424264, 0.372435, 0.536186, 0.644572, 0.809689, 0.825804, 0.883642, 1.0102, 1.10725 -elapsed time for k point: 0.11198806762695312 +elapsed time for k point: 0.11118173599243164 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88870,7 +88897,7 @@ iteration 29: trace = 5.417088766409222 (6.15501e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 14, 0.2, 0.2, 0, 0.282843, 0.252088, 0.542887, 0.698081, 0.789371, 0.888483, 0.897858, 1.07884, 1.09039 -elapsed time for k point: 0.23376727104187012 +elapsed time for k point: 0.15062880516052246 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -88943,7 +88970,7 @@ iteration 34: trace = 5.522267645664736 (5.17409e-11% change) Finished solving for bands 1 to 8 after 34 iterations. tefreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.126841, 0.549908, 0.750378, 0.777261, 0.903059, 0.961984, 1.04191, 1.10004 -elapsed time for k point: 0.17826342582702637 +elapsed time for k point: 0.17780590057373047 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -89138,7 +89165,7 @@ iteration 93: trace = 5.548117725324985 (3.6948e-11% change) Finished solving for bands 2 to 8 after 93 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.552709, 0.773227, 0.77323, 0.922997, 1.00017, 1.00017, 1.09282 -elapsed time for k point: 0.36122608184814453 +elapsed time for k point: 0.35391902923583984 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.49683586474489877 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4415884497226764 at Vector3<0.5, 0.0, 0.0> to 0.5931405141160889 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.5931535863117833 at Vector3<0.5, 0.5, 0.0> to 0.7732265593069757 at Vector3<0.0, 0.0, 0.0> @@ -89150,13 +89177,13 @@ Gap from band 2 (0.5931405141160889) to band 3 (0.5931535863117833), 0.002203870977633219% Gap from band 4 (0.8096891551677093) to band 5 (0.8241814443502165), 1.77398249124295% Gap from band 7 (1.0860729323744873) to band 8 (1.0878689635115244), 0.16523267162162025% -total elapsed time for run: 3.215769052505493 +total elapsed time for run: 3.0577964782714844 done epsilon: 1-12, mean 2.38229, harm. mean 1.1448, 14.5508% > 1, 12.5663% "fill" -.Outputting /tmp/meepWcFBDI/test_subpixel_averaging-0-epsilon.h5... -/tmp/meepWcFBDI/test_subpixel_averaging-0: 3.24s +.Outputting /tmp/meephWM0hz/test_subpixel_averaging-0-epsilon.h5... +/tmp/meephWM0hz/test_subpixel_averaging-0: 3.08s -/tmp/meepWcFBDI/test_symmetry_overlap-0 +/tmp/meephWM0hz/test_symmetry_overlap-0 ======================== Initializing eigensolver data Computing 6 bands with 1e-12 tolerance @@ -89184,7 +89211,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.5> -elapsed time for initialization: 0.09364128112792969 +elapsed time for initialization: 0.11706852912902832 solve_kpoint (0.5,0.5,0.5): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3, band 4, band 5, band 6 Solving for bands 1 to 6... @@ -89245,8 +89272,8 @@ iteration 27: trace = 2.040338191456635 (3.16905e-11% change) Finished solving for bands 1 to 6 after 27 iterations. freqs:, 1, 0.5, 0.5, 0.5, 0.866025, 0.526821, 0.526823, 0.526827, 0.634476, 0.634485, 0.634491 -elapsed time for k point: 3.427274703979492 -total elapsed time for run: 3.520991086959839 +elapsed time for k point: 3.689959764480591 +total elapsed time for run: 3.8071045875549316 done Initializing eigensolver data Computing 6 bands with 1e-12 tolerance @@ -89273,7 +89300,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0936422348022461 +elapsed time for initialization: 0.09018492698669434 solve_kpoint (0,0,0): zevenfreqs:, k index, k1, k2, k3, kmag/2pi, zeven band 1, zeven band 2, zeven band 3, zeven band 4, zeven band 5, zeven band 6 Solving for bands 2 to 6... @@ -89442,8 +89469,8 @@ iteration 80: trace = 2.470089841242355 (9.58263e-12% change) Finished solving for bands 2 to 6 after 80 iterations. zevenfreqs:, 1, 0, 0, 0, 0, 0, 0.548551, 0.707219, 0.707226, 0.764464, 0.764493 -elapsed time for k point: 7.941910982131958 -total elapsed time for run: 8.035640954971313 +elapsed time for k point: 7.941498517990112 +total elapsed time for run: 8.031766653060913 done Initializing eigensolver data Computing 6 bands with 1e-12 tolerance @@ -89470,7 +89497,7 @@ Initializing fields to random numbers... 1 k-points Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.08819198608398438 +elapsed time for initialization: 0.090301513671875 solve_kpoint (0,0,0): zoddfreqs:, k index, k1, k2, k3, kmag/2pi, zodd band 1, zodd band 2, zodd band 3, zodd band 4, zodd band 5, zodd band 6 Solving for bands 2 to 6... @@ -89539,12 +89566,12 @@ iteration 31: trace = 2.293372879533615 (4.12841e-11% change) Finished solving for bands 2 to 6 after 31 iterations. zoddfreqs:, 1, 0, 0, 0, 0, 0, 0.548559, 0.548564, 0.707153, 0.764184, 0.779416 -.elapsed time for k point: 2.9826598167419434 -total elapsed time for run: 3.0709471702575684 +.elapsed time for k point: 2.9182727336883545 +total elapsed time for run: 3.008683919906616 done -/tmp/meepWcFBDI/test_symmetry_overlap-0: 15.87s +/tmp/meephWM0hz/test_symmetry_overlap-0: 15.95s -/tmp/meepWcFBDI/test_tri_holes-0 +/tmp/meephWM0hz/test_tri_holes-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -89587,7 +89614,7 @@ Vector3<-0.1333333333333333, 0.1333333333333333, 0.0> Vector3<-0.06666666666666665, 0.06666666666666665, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.004847049713134766 +elapsed time for initialization: 0.006326436996459961 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -89709,7 +89736,7 @@ iteration 56: trace = 4.451949513355896 (5.71377e-11% change) Finished solving for bands 2 to 8 after 56 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.656836, 0.715623, 0.716068, 0.738377, 0.825979, 0.827163, 1.04116 -elapsed time for k point: 0.21626663208007812 +elapsed time for k point: 0.2823011875152588 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -89818,7 +89845,7 @@ iteration 51: trace = 4.458889461747217 (4.21492e-11% change) Finished solving for bands 1 to 8 after 51 iterations. tefreqs:, 2, 0, 0.1, 0, 0.11547, 0.0694821, 0.652351, 0.679959, 0.706966, 0.760813, 0.839484, 0.84298, 1.03546 -elapsed time for k point: 0.26476097106933594 +elapsed time for k point: 0.34166836738586426 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -89879,7 +89906,7 @@ iteration 28: trace = 4.481554639580323 (5.7553e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 3, 0, 0.2, 0, 0.23094, 0.137272, 0.615214, 0.658316, 0.688898, 0.777327, 0.869983, 0.879951, 1.02022 -elapsed time for k point: 0.14651274681091309 +elapsed time for k point: 0.18951034545898438 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -89938,7 +89965,7 @@ iteration 27: trace = 4.534239367259124 (5.23202e-11% change) Finished solving for bands 1 to 8 after 27 iterations. tefreqs:, 4, 0, 0.3, 0, 0.34641, 0.200458, 0.560713, 0.652934, 0.672026, 0.788475, 0.905474, 0.920288, 1.00658 -elapsed time for k point: 0.14157390594482422 +elapsed time for k point: 0.18374180793762207 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -90003,7 +90030,7 @@ iteration 30: trace = 4.607273350205861 (7.40073e-11% change) Finished solving for bands 1 to 8 after 30 iterations. tefreqs:, 5, 0, 0.4, 0, 0.46188, 0.251902, 0.513413, 0.649737, 0.660743, 0.79604, 0.93646, 0.952374, 1.00191 -elapsed time for k point: 0.15694093704223633 +elapsed time for k point: 0.20373249053955078 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -90078,7 +90105,7 @@ iteration 35: trace = 4.654583747911486 (5.96497e-11% change) Finished solving for bands 1 to 8 after 35 iterations. tefreqs:, 6, 0, 0.5, 0, 0.57735, 0.274155, 0.492434, 0.648615, 0.656803, 0.798817, 0.949956, 0.963485, 1.00797 -elapsed time for k point: 0.18269968032836914 +elapsed time for k point: 0.23692893981933594 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -90139,7 +90166,7 @@ iteration 28: trace = 4.657802402861529 (2.98042e-11% change) Finished solving for bands 1 to 8 after 28 iterations. tefreqs:, 7, -0.0666667, 0.466667, 0, 0.581187, 0.276103, 0.493884, 0.623964, 0.680084, 0.79654, 0.952442, 0.963435, 1.00796 -elapsed time for k point: 0.14650893211364746 +elapsed time for k point: 0.18955612182617188 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -90206,7 +90233,7 @@ iteration 31: trace = 4.667096098888678 (7.49046e-11% change) Finished solving for bands 1 to 8 after 31 iterations. tefreqs:, 8, -0.133333, 0.433333, 0, 0.592546, 0.281494, 0.498189, 0.595471, 0.70467, 0.790197, 0.959226, 0.963379, 1.00792 -elapsed time for k point: 0.16185784339904785 +elapsed time for k point: 0.21245479583740234 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -90273,7 +90300,7 @@ iteration 31: trace = 4.681614604980842 (5.62319e-11% change) Finished solving for bands 1 to 8 after 31 iterations. tefreqs:, 9, -0.2, 0.4, 0, 0.61101, 0.288945, 0.505245, 0.568143, 0.726282, 0.780907, 0.962873, 0.969263, 1.00805 -elapsed time for k point: 0.16182684898376465 +elapsed time for k point: 0.20951437950134277 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -90342,7 +90369,7 @@ iteration 32: trace = 4.699960544782293 (8.86485e-11% change) Finished solving for bands 1 to 8 after 32 iterations. tefreqs:, 10, -0.266667, 0.366667, 0, 0.635959, 0.29604, 0.514888, 0.544209, 0.744263, 0.76985, 0.962861, 0.978949, 1.00946 -elapsed time for k point: 0.2671222686767578 +elapsed time for k point: 0.21845388412475586 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -90457,7 +90484,7 @@ iteration 54: trace = 4.719164720216042 (5.79677e-11% change) Finished solving for bands 1 to 8 after 54 iterations. tefreqs:, 11, -0.333333, 0.333333, 0, 0.666667, 0.299305, 0.526635, 0.526971, 0.757838, 0.758439, 0.962922, 0.983456, 1.01518 -elapsed time for k point: 0.28563761711120605 +elapsed time for k point: 0.35993170738220215 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -90520,7 +90547,7 @@ iteration 29: trace = 4.653956804049425 (5.66615e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 12, -0.266667, 0.266667, 0, 0.533333, 0.280656, 0.522942, 0.556626, 0.735071, 0.77423, 0.95812, 0.968138, 0.99842 -elapsed time for k point: 0.1588120460510254 +elapsed time for k point: 0.19374585151672363 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -90577,7 +90604,7 @@ iteration 26: trace = 4.565737534032815 (6.60823e-11% change) Finished solving for bands 1 to 8 after 26 iterations. tefreqs:, 13, -0.2, 0.2, 0, 0.4, 0.227959, 0.557659, 0.592002, 0.715363, 0.778635, 0.930406, 0.931674, 1.00032 -elapsed time for k point: 0.13754510879516602 +elapsed time for k point: 0.17480111122131348 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... linmin: converged after 6 iterations. @@ -90632,7 +90659,7 @@ iteration 25: trace = 4.495299578884352 (5.15485e-11% change) Finished solving for bands 1 to 8 after 25 iterations. tefreqs:, 14, -0.133333, 0.133333, 0, 0.266667, 0.157628, 0.611565, 0.627491, 0.703542, 0.775273, 0.887377, 0.887503, 1.01567 -elapsed time for k point: 0.13152503967285156 +elapsed time for k point: 0.170058012008667 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -90700,7 +90727,7 @@ iteration 31: trace = 4.46256992066141 (8.68759e-11% change) Finished solving for bands 1 to 8 after 31 iterations. tefreqs:, 15, -0.0666667, 0.0666667, 0, 0.133333, 0.0801245, 0.65125, 0.670687, 0.706804, 0.763085, 0.844811, 0.846761, 1.03423 -elapsed time for k point: 0.16723370552062988 +elapsed time for k point: 0.20888733863830566 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 4 iterations. @@ -90929,7 +90956,7 @@ iteration 109: trace = 4.451949513352748 (8.8759e-11% change) Finished solving for bands 2 to 8 after 109 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.656836, 0.715623, 0.716068, 0.738377, 0.825979, 0.827163, 1.04116 -elapsed time for k point: 0.4178166389465332 +elapsed time for k point: 0.44353413581848145 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.2993049473117485 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> Band 2 range: 0.49243428236220677 at Vector3<0.0, 0.5, 0.0> to 0.6568362683499384 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.5269710506448813 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> to 0.7156232200212513 at Vector3<0.0, 0.0, 0.0> @@ -90941,7 +90968,7 @@ Gap from band 1 (0.2993049473117485) to band 2 (0.49243428236220677), 48.78609719263008% Gap from band 5 (0.7988168792802606) to band 6 (0.8259787164701545), 3.3434159054756925% Gap from band 7 (0.9834563303529592) to band 8 (0.9984200611839892), 1.510056923320589% -total elapsed time for run: 3.150521755218506 +total elapsed time for run: 3.8264145851135254 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -90983,7 +91010,7 @@ Vector3<-0.1333333333333333, 0.1333333333333333, 0.0> Vector3<-0.06666666666666665, 0.06666666666666665, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0047702789306640625 +elapsed time for initialization: 0.0052301883697509766 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8 Solving for bands 2 to 8... @@ -91052,7 +91079,7 @@ iteration 31: trace = 2.862490688618994 (4.5751e-11% change) Finished solving for bands 2 to 8 after 31 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.398513, 0.492888, 0.493368, 0.682486, 0.682532, 0.692015, 0.898224 -elapsed time for k point: 0.12092781066894531 +elapsed time for k point: 0.12198352813720703 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91097,7 +91124,7 @@ iteration 20: trace = 2.835301328478711 (6.86346e-11% change) Finished solving for bands 1 to 8 after 20 iterations. tmfreqs:, 2, 0, 0.1, 0, 0.11547, 0.0581198, 0.391139, 0.491701, 0.498714, 0.658377, 0.683973, 0.717136, 0.879138 -elapsed time for k point: 0.10669708251953125 +elapsed time for k point: 0.10678672790527344 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... linmin: converged after 6 iterations. @@ -91134,7 +91161,7 @@ iteration 16: trace = 2.795630871597677 (2.51461e-11% change) Finished solving for bands 1 to 8 after 16 iterations. tmfreqs:, 3, 0, 0.2, 0, 0.23094, 0.114967, 0.372435, 0.488376, 0.510297, 0.634188, 0.687769, 0.745313, 0.845031 -elapsed time for k point: 0.08561921119689941 +elapsed time for k point: 0.08421754837036133 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... linmin: converged after 6 iterations. @@ -91167,7 +91194,7 @@ iteration 14: trace = 2.771565390381674 (1.59109e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 4, 0, 0.3, 0, 0.34641, 0.169005, 0.346637, 0.484408, 0.520098, 0.618254, 0.692346, 0.770438, 0.813964 -elapsed time for k point: 0.07513022422790527 +elapsed time for k point: 0.0742197036743164 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -91198,7 +91225,7 @@ iteration 13: trace = 2.764617094107786 (7.09517e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 5, 0, 0.4, 0, 0.46188, 0.217539, 0.316063, 0.481302, 0.523954, 0.612544, 0.695969, 0.784104, 0.798008 -elapsed time for k point: 0.07014846801757812 +elapsed time for k point: 0.06908512115478516 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -91233,7 +91260,7 @@ iteration 15: trace = 2.765514654374657 (5.36822e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 6, 0, 0.5, 0, 0.57735, 0.246221, 0.2936, 0.480139, 0.524322, 0.612077, 0.697337, 0.77948, 0.802954 -elapsed time for k point: 0.08215212821960449 +elapsed time for k point: 0.07903480529785156 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91266,7 +91293,7 @@ iteration 14: trace = 2.765656097342635 (9.75962e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 7, -0.0666667, 0.466667, 0, 0.581187, 0.247714, 0.293902, 0.474174, 0.530395, 0.610517, 0.697722, 0.778384, 0.803945 -elapsed time for k point: 0.07564020156860352 +elapsed time for k point: 0.07421326637268066 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91301,7 +91328,7 @@ iteration 15: trace = 2.76644039305337 (2.33728e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 8, -0.133333, 0.433333, 0, 0.592546, 0.252117, 0.294341, 0.462144, 0.543033, 0.606057, 0.698701, 0.775411, 0.806864 -elapsed time for k point: 0.08163905143737793 +elapsed time for k point: 0.07931876182556152 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91336,7 +91363,7 @@ iteration 15: trace = 2.768905996249792 (5.59421e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 9, -0.2, 0.4, 0, 0.61101, 0.259212, 0.293544, 0.450321, 0.556823, 0.599242, 0.699858, 0.771489, 0.811554 -elapsed time for k point: 0.08113431930541992 +elapsed time for k point: 0.07992100715637207 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91373,7 +91400,7 @@ iteration 16: trace = 2.774529530826203 (2.40889e-11% change) Finished solving for bands 1 to 8 after 16 iterations. tmfreqs:, 10, -0.266667, 0.366667, 0, 0.635959, 0.268674, 0.289451, 0.441996, 0.569747, 0.590701, 0.700763, 0.768006, 0.817777 -elapsed time for k point: 0.08704423904418945 +elapsed time for k point: 0.08439159393310547 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -91435,7 +91462,7 @@ iteration 27: trace = 2.784404130698573 (2.0064e-11% change) Finished solving for bands 1 to 8 after 27 iterations. tmfreqs:, 11, -0.333333, 0.333333, 0, 0.666667, 0.280092, 0.280155, 0.439082, 0.58087, 0.581035, 0.701106, 0.766461, 0.825015 -elapsed time for k point: 0.14289617538452148 +elapsed time for k point: 0.13956642150878906 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91470,7 +91497,7 @@ iteration 15: trace = 2.766275694185349 (1.16389e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 12, -0.266667, 0.266667, 0, 0.533333, 0.244445, 0.307226, 0.448708, 0.559739, 0.597235, 0.699583, 0.773933, 0.80772 -elapsed time for k point: 0.08724069595336914 +elapsed time for k point: 0.07948756217956543 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 7 iterations. @@ -91501,7 +91528,7 @@ iteration 13: trace = 2.765766574968634 (1.11112e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 13, -0.2, 0.2, 0, 0.4, 0.192601, 0.336978, 0.467722, 0.538055, 0.609757, 0.695231, 0.77985, 0.802206 -elapsed time for k point: 0.08701491355895996 +elapsed time for k point: 0.06948089599609375 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91532,7 +91559,7 @@ iteration 13: trace = 2.786825446005424 (1.53776e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 14, -0.133333, 0.133333, 0, 0.266667, 0.132075, 0.365778, 0.483253, 0.517524, 0.627555, 0.689432, 0.753492, 0.835064 -elapsed time for k point: 0.08022546768188477 +elapsed time for k point: 0.06961274147033691 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... linmin: converged after 8 iterations. @@ -91573,7 +91600,7 @@ iteration 18: trace = 2.829270279885345 (1.59631e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tmfreqs:, 15, -0.0666667, 0.0666667, 0, 0.133333, 0.0670312, 0.388874, 0.490908, 0.500671, 0.654295, 0.684452, 0.721561, 0.874451 -elapsed time for k point: 0.10253524780273438 +elapsed time for k point: 0.09493589401245117 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 5 iterations. @@ -91641,7 +91668,7 @@ iteration 31: trace = 2.862490688618617 (3.02059e-11% change) Finished solving for bands 2 to 8 after 31 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.398513, 0.492888, 0.493368, 0.682486, 0.682532, 0.692015, 0.898224 -.elapsed time for k point: 0.12632226943969727 +.elapsed time for k point: 0.1202390193939209 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.2800915681739995 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> Band 2 range: 0.2801552391378441 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> to 0.3985126081046686 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.43908172284486047 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> to 0.49288810189980703 at Vector3<0.0, 0.0, 0.0> @@ -91656,11 +91683,11 @@ Gap from band 4 (0.5808701365268195) to band 5 (0.5810352468043719), 0.028420606345590967% Gap from band 5 (0.6824860801373002) to band 6 (0.6825317446715008), 0.006690686871730083% Gap from band 7 (0.7841042622393093) to band 8 (0.7980077872594111), 1.7575904341929585% -total elapsed time for run: 1.4981989860534668 +total elapsed time for run: 1.4327430725097656 done -/tmp/meepWcFBDI/test_tri_holes-0: 5.40s +/tmp/meephWM0hz/test_tri_holes-0: 6.73s -/tmp/meepWcFBDI/test_tri_rods-0 +/tmp/meephWM0hz/test_tri_rods-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -91702,7 +91729,7 @@ Vector3<-0.1333333333333333, 0.1333333333333333, 0.0> Vector3<-0.06666666666666665, 0.06666666666666665, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0026903152465820312 +elapsed time for initialization: 0.002609729766845703 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8 Solving for bands 2 to 8... @@ -91757,7 +91784,7 @@ iteration 24: trace = 4.577894626572786 (4.46816e-11% change) Finished solving for bands 2 to 8 after 24 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.560518, 0.560561, 0.593296, 0.837451, 0.837595, 0.994129, 1.09832 -elapsed time for k point: 0.09549474716186523 +elapsed time for k point: 0.09445881843566895 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -91798,7 +91825,7 @@ iteration 18: trace = 4.546667003404457 (4.24489e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tmfreqs:, 2, 0, 0.1, 0, 0.11547, 0.0711319, 0.538981, 0.559429, 0.617095, 0.834123, 0.839462, 0.988272, 1.08637 -elapsed time for k point: 0.10795354843139648 +elapsed time for k point: 0.09534430503845215 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91833,7 +91860,7 @@ iteration 15: trace = 4.456771796562712 (4.07941e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 3, 0, 0.2, 0, 0.23094, 0.138898, 0.508574, 0.556587, 0.65398, 0.825087, 0.84452, 0.968999, 1.05281 -elapsed time for k point: 0.0808115005493164 +elapsed time for k point: 0.14990711212158203 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91866,7 +91893,7 @@ iteration 14: trace = 4.364565233298257 (3.14404e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 4, 0, 0.3, 0, 0.34641, 0.198939, 0.479631, 0.553145, 0.693119, 0.813353, 0.850964, 0.932869, 1.02598 -elapsed time for k point: 0.0778965950012207 +elapsed time for k point: 0.07476925849914551 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91897,7 +91924,7 @@ iteration 13: trace = 4.304069964437605 (7.18538e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 5, 0, 0.4, 0, 0.46188, 0.244064, 0.4557, 0.550414, 0.730028, 0.80289, 0.856372, 0.891379, 1.01409 -elapsed time for k point: 0.07044219970703125 +elapsed time for k point: 0.06948971748352051 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91928,7 +91955,7 @@ iteration 13: trace = 4.283477065616431 (4.14492e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 6, 0, 0.5, 0, 0.57735, 0.262015, 0.445331, 0.549383, 0.749186, 0.797864, 0.85849, 0.870609, 1.01087 -elapsed time for k point: 0.07039809226989746 +elapsed time for k point: 0.06914997100830078 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91957,7 +91984,7 @@ iteration 12: trace = 4.264474631199774 (8.73084e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 7, -0.0666667, 0.466667, 0, 0.581187, 0.262984, 0.4475, 0.545804, 0.752448, 0.797093, 0.860461, 0.870245, 0.99895 -elapsed time for k point: 0.06566524505615234 +elapsed time for k point: 0.06463336944580078 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -91986,7 +92013,7 @@ iteration 12: trace = 4.228595652264469 (8.17059e-12% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 8, -0.133333, 0.433333, 0, 0.592546, 0.265671, 0.453801, 0.535912, 0.761319, 0.795166, 0.866056, 0.869135, 0.973413 -elapsed time for k point: 0.06525254249572754 +elapsed time for k point: 0.06459426879882812 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -92011,7 +92038,7 @@ iteration 10: trace = 4.196577821229713 (9.14088e-11% change) Finished solving for bands 1 to 8 after 10 iterations. tmfreqs:, 9, -0.2, 0.4, 0, 0.61101, 0.269404, 0.463648, 0.52172, 0.773443, 0.792931, 0.867201, 0.874681, 0.94487 -elapsed time for k point: 0.05514883995056152 +elapsed time for k point: 0.054509878158569336 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -92036,7 +92063,7 @@ iteration 10: trace = 4.175651761333514 (5.29421e-11% change) Finished solving for bands 1 to 8 after 10 iterations. tmfreqs:, 10, -0.266667, 0.366667, 0, 0.635959, 0.273, 0.476141, 0.505606, 0.78524, 0.791235, 0.864672, 0.885801, 0.918597 -elapsed time for k point: 0.05544781684875488 +elapsed time for k point: 0.05435895919799805 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -92059,23 +92086,23 @@ iteration 9: trace = 4.168411689609144 (8.91074e-11% change) Finished solving for bands 1 to 8 after 9 iterations. tmfreqs:, 11, -0.333333, 0.333333, 0, 0.666667, 0.27469, 0.489984, 0.490239, 0.79072, 0.790832, 0.863041, 0.899109, 0.89925 -elapsed time for k point: 0.050098419189453125 +elapsed time for k point: 0.04909038543701172 Fixing e-field (band 1) phase by -1 + 4.11972e-08i; max ampl. = 0.93911 -Outputting fields to /tmp/meepWcFBDI/test_tri_rods-0-e.k11.b01.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_tri_rods-0-e.k11.b01.z.tm.h5... Fixing e-field (band 2) phase by -4.11972e-08 + -1i; max ampl. = 1.08316 -Outputting fields to /tmp/meepWcFBDI/test_tri_rods-0-e.k11.b02.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_tri_rods-0-e.k11.b02.z.tm.h5... Fixing e-field (band 3) phase by 1 + -4.11972e-08i; max ampl. = 0.877953 -Outputting fields to /tmp/meepWcFBDI/test_tri_rods-0-e.k11.b03.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_tri_rods-0-e.k11.b03.z.tm.h5... Fixing e-field (band 4) phase by 1 + -4.11971e-08i; max ampl. = 1.24657 -Outputting fields to /tmp/meepWcFBDI/test_tri_rods-0-e.k11.b04.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_tri_rods-0-e.k11.b04.z.tm.h5... Fixing e-field (band 5) phase by 4.11971e-08 + 1i; max ampl. = 1.10168 -Outputting fields to /tmp/meepWcFBDI/test_tri_rods-0-e.k11.b05.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_tri_rods-0-e.k11.b05.z.tm.h5... Fixing e-field (band 6) phase by -1 + 4.11972e-08i; max ampl. = 1.76186 -Outputting fields to /tmp/meepWcFBDI/test_tri_rods-0-e.k11.b06.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_tri_rods-0-e.k11.b06.z.tm.h5... Fixing e-field (band 7) phase by -1 + 4.11972e-08i; max ampl. = 1.0881 -Outputting fields to /tmp/meepWcFBDI/test_tri_rods-0-e.k11.b07.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_tri_rods-0-e.k11.b07.z.tm.h5... Fixing e-field (band 8) phase by -1 + 4.11972e-08i; max ampl. = 1.08096 -Outputting fields to /tmp/meepWcFBDI/test_tri_rods-0-e.k11.b08.z.tm.h5... +Outputting fields to /tmp/meephWM0hz/test_tri_rods-0-e.k11.b08.z.tm.h5... solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -92102,7 +92129,7 @@ iteration 11: trace = 4.197854050309301 (1.33718e-11% change) Finished solving for bands 1 to 8 after 11 iterations. tmfreqs:, 12, -0.266667, 0.266667, 0, 0.533333, 0.2632, 0.47091, 0.51804, 0.764413, 0.795091, 0.864427, 0.896871, 0.932925 -elapsed time for k point: 0.060393333435058594 +elapsed time for k point: 0.059859514236450195 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -92131,7 +92158,7 @@ iteration 12: trace = 4.283266488990683 (1.11767e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 13, -0.2, 0.2, 0, 0.4, 0.222593, 0.476537, 0.539917, 0.715636, 0.806516, 0.856013, 0.929969, 0.977199 -elapsed time for k point: 0.06537532806396484 +elapsed time for k point: 0.06424760818481445 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -92162,7 +92189,7 @@ iteration 13: trace = 4.410102274545242 (2.51544e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 14, -0.133333, 0.133333, 0, 0.266667, 0.15856, 0.501245, 0.552927, 0.666818, 0.82116, 0.846938, 0.963589, 1.03113 -elapsed time for k point: 0.07021188735961914 +elapsed time for k point: 0.0707235336303711 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -92201,7 +92228,7 @@ iteration 17: trace = 4.534517622757207 (7.8407e-11% change) Finished solving for bands 1 to 8 after 17 iterations. tmfreqs:, 15, -0.0666667, 0.0666667, 0, 0.133333, 0.0819275, 0.534465, 0.558896, 0.622523, 0.832982, 0.840137, 0.98638, 1.08149 -elapsed time for k point: 0.09043645858764648 +elapsed time for k point: 0.0897970199584961 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 4 iterations. @@ -92238,7 +92265,7 @@ iteration 16: trace = 4.577894626572483 (2.55905e-11% change) Finished solving for bands 2 to 8 after 16 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.560518, 0.560561, 0.593296, 0.837451, 0.837595, 0.994129, 1.09832 -elapsed time for k point: 0.06369805335998535 +elapsed time for k point: 0.06759905815124512 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.2746902258623629 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> Band 2 range: 0.44533108084715833 at Vector3<0.0, 0.5, 0.0> to 0.5605181423162844 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.49023891490276683 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> to 0.5605607947797752 at Vector3<0.0, 0.0, 0.0> @@ -92252,7 +92279,7 @@ Gap from band 4 (0.79071959744437) to band 5 (0.7908320763327578), 0.014223865113315824% Gap from band 5 (0.8374511167537574) to band 6 (0.8375948528443272), 0.017162047272568082% Gap from band 6 (0.8672009264903449) to band 7 (0.8691349955739198), 0.2227759109280675% -total elapsed time for run: 1.169363021850586 +total elapsed time for run: 1.2136225700378418 done Read lattice vectors Read Bloch wavevector (-0.333333, 0.333333, 0) @@ -92302,7 +92329,7 @@ Vector3<-0.1333333333333333, 0.1333333333333333, 0.0> Vector3<-0.06666666666666665, 0.06666666666666665, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0027065277099609375 +elapsed time for initialization: 0.0035009384155273438 solve_kpoint (0,0,0): tefreqs:, k index, k1, k2, k3, kmag/2pi, te band 1, te band 2, te band 3, te band 4, te band 5, te band 6, te band 7, te band 8 Solving for bands 2 to 8... @@ -92421,7 +92448,7 @@ iteration 56: trace = 6.2053376471259 (6.91324e-11% change) Finished solving for bands 2 to 8 after 56 iterations. tefreqs:, 1, 0, 0, 0, 0, 0, 0.561229, 0.793929, 0.794659, 1.03341, 1.03342, 1.11597, 1.11681 -elapsed time for k point: 0.21721649169921875 +elapsed time for k point: 0.2864532470703125 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -92488,7 +92515,7 @@ iteration 31: trace = 6.070460070673311 (7.67697e-11% change) Finished solving for bands 1 to 8 after 31 iterations. tefreqs:, 2, 0, 0.1, 0, 0.11547, 0.101865, 0.559805, 0.79146, 0.793258, 0.992126, 1.02845, 1.09799, 1.1151 -elapsed time for k point: 0.16359710693359375 +elapsed time for k point: 0.21302294731140137 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -92551,7 +92578,7 @@ iteration 29: trace = 5.856237734706172 (2.88009e-11% change) Finished solving for bands 1 to 8 after 29 iterations. tefreqs:, 3, 0, 0.2, 0, 0.23094, 0.202662, 0.555133, 0.784265, 0.784932, 0.925328, 1.01804, 1.06979, 1.11298 -elapsed time for k point: 0.1543886661529541 +elapsed time for k point: 0.19654178619384766 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -92606,7 +92633,7 @@ iteration 25: trace = 5.679316226598068 (4.88557e-11% change) Finished solving for bands 1 to 8 after 25 iterations. tefreqs:, 4, 0, 0.3, 0, 0.34641, 0.300756, 0.545003, 0.752836, 0.776604, 0.881527, 1.00851, 1.04494, 1.1117 -elapsed time for k point: 0.13337492942810059 +elapsed time for k point: 0.169783353805542 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -92657,7 +92684,7 @@ iteration 23: trace = 5.567356944539215 (5.37148e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 5, 0, 0.4, 0, 0.46188, 0.392756, 0.521577, 0.705571, 0.77011, 0.86865, 1.00251, 1.02766, 1.11107 -elapsed time for k point: 0.12223601341247559 +elapsed time for k point: 0.15778684616088867 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -92706,7 +92733,7 @@ iteration 22: trace = 5.529271313719444 (3.44074e-11% change) Finished solving for bands 1 to 8 after 22 iterations. tefreqs:, 6, 0, 0.5, 0, 0.57735, 0.468428, 0.473072, 0.683225, 0.767661, 0.866987, 1.00052, 1.02137, 1.11088 -elapsed time for k point: 0.11794757843017578 +elapsed time for k point: 0.15082097053527832 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -92759,7 +92786,7 @@ iteration 24: trace = 5.532153606068912 (8.05471e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 7, -0.0666667, 0.466667, 0, 0.581187, 0.472654, 0.474197, 0.67604, 0.772695, 0.866879, 0.969813, 1.05066, 1.11081 -elapsed time for k point: 0.12671899795532227 +elapsed time for k point: 0.16588926315307617 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -92812,7 +92839,7 @@ iteration 24: trace = 5.534695993739177 (6.49762e-11% change) Finished solving for bands 1 to 8 after 24 iterations. tefreqs:, 8, -0.133333, 0.433333, 0, 0.592546, 0.477432, 0.485081, 0.657266, 0.784802, 0.866577, 0.932933, 1.08112, 1.11059 -elapsed time for k point: 0.1271822452545166 +elapsed time for k point: 0.16399002075195312 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -92863,7 +92890,7 @@ iteration 23: trace = 5.527140023966949 (5.31415e-11% change) Finished solving for bands 1 to 8 after 23 iterations. tefreqs:, 9, -0.2, 0.4, 0, 0.61101, 0.48232, 0.50501, 0.630584, 0.799745, 0.866126, 0.900465, 1.09936, 1.11024 -elapsed time for k point: 0.12155771255493164 +elapsed time for k point: 0.15830564498901367 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -92912,7 +92939,7 @@ iteration 22: trace = 5.514581486526163 (5.58073e-11% change) Finished solving for bands 1 to 8 after 22 iterations. tefreqs:, 10, -0.266667, 0.366667, 0, 0.635959, 0.487852, 0.531427, 0.598151, 0.814208, 0.865617, 0.875643, 1.10711, 1.10983 -elapsed time for k point: 0.2442164421081543 +elapsed time for k point: 0.14528155326843262 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -92955,7 +92982,7 @@ iteration 19: trace = 5.508642232131618 (7.05397e-11% change) Finished solving for bands 1 to 8 after 19 iterations. tefreqs:, 11, -0.333333, 0.333333, 0, 0.666667, 0.491236, 0.563106, 0.563151, 0.821423, 0.865195, 0.865231, 1.10923, 1.10941 -elapsed time for k point: 0.10303163528442383 +elapsed time for k point: 0.1146855354309082 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -93002,7 +93029,7 @@ iteration 21: trace = 5.538947612933677 (6.50706e-11% change) Finished solving for bands 1 to 8 after 21 iterations. tefreqs:, 12, -0.266667, 0.266667, 0, 0.533333, 0.446126, 0.532191, 0.637012, 0.806654, 0.86614, 0.893198, 1.10593, 1.10866 -elapsed time for k point: 0.11356401443481445 +elapsed time for k point: 0.11477994918823242 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 3 iterations. @@ -93051,7 +93078,7 @@ iteration 22: trace = 5.636892705526576 (7.80736e-11% change) Finished solving for bands 1 to 8 after 22 iterations. tefreqs:, 13, -0.2, 0.2, 0, 0.4, 0.345267, 0.542882, 0.713396, 0.795022, 0.875814, 0.938821, 1.09707, 1.10904 -elapsed time for k point: 0.11719870567321777 +elapsed time for k point: 0.11673951148986816 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -93110,7 +93137,7 @@ iteration 27: trace = 5.807436111839944 (8.67312e-11% change) Finished solving for bands 1 to 8 after 27 iterations. tefreqs:, 14, -0.133333, 0.133333, 0, 0.266667, 0.233479, 0.553269, 0.768719, 0.792196, 0.912766, 0.987203, 1.08919, 1.11098 -elapsed time for k point: 0.14248418807983398 +elapsed time for k point: 0.14417552947998047 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -93181,7 +93208,7 @@ iteration 33: trace = 6.039148745478514 (4.54594e-11% change) Finished solving for bands 1 to 8 after 33 iterations. tefreqs:, 15, -0.0666667, 0.0666667, 0, 0.133333, 0.117556, 0.559323, 0.789736, 0.793576, 0.983043, 1.02374, 1.09661, 1.11448 -elapsed time for k point: 0.17337393760681152 +elapsed time for k point: 0.17339658737182617 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 6 iterations. @@ -93256,7 +93283,7 @@ iteration 35: trace = 6.205337647122204 (8.29732e-11% change) Finished solving for bands 2 to 8 after 35 iterations. tefreqs:, 16, 0, 0, 0, 0, 0, 0.561229, 0.793929, 0.794659, 1.03341, 1.03342, 1.11597, 1.11681 -elapsed time for k point: 0.13628602027893066 +elapsed time for k point: 0.13628029823303223 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.491235811867578 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> Band 2 range: 0.4730722390280758 at Vector3<0.0, 0.5, 0.0> to 0.5631059378714031 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> Band 3 range: 0.5631505198559041 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> to 0.7939289395839753 at Vector3<0.0, 0.0, 0.0> @@ -93267,7 +93294,7 @@ Band 8 range: 1.1086626585374242 at Vector3<-0.26666666666666666, 0.26666666666666666, 0.0> to 1.1168107191255332 at Vector3<0.0, 0.0, 0.0> Gap from band 2 (0.5631059378714031) to band 3 (0.5631505198559041), 0.007916844195689235% Gap from band 4 (0.8214230044191522) to band 5 (0.8651948144415262), 5.190483526605004% -total elapsed time for run: 2.3181722164154053 +total elapsed time for run: 2.6126468181610107 done epsilon: 1-12, mean 2.59614, harm. mean 1.17149, 17.2852% > 1, 14.5104% "fill" Read lattice vectors @@ -93277,9 +93304,9 @@ Input data is rank 2, size 32x32x1. Output data 96x83x1 real part range: 1 .. 12 -./tmp/meepWcFBDI/test_tri_rods-0: 5.16s +./tmp/meephWM0hz/test_tri_rods-0: 3.92s -/tmp/meepWcFBDI/test_triangular_lattice-0 +/tmp/meephWM0hz/test_triangular_lattice-0 ======================== Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -93322,7 +93349,7 @@ Vector3<-0.1333333333333333, 0.1333333333333333, 0.0> Vector3<-0.06666666666666665, 0.06666666666666665, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0025441646575927734 +elapsed time for initialization: 0.0026090145111083984 solve_kpoint (0,0,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1, tm band 2, tm band 3, tm band 4, tm band 5, tm band 6, tm band 7, tm band 8 Solving for bands 2 to 8... @@ -93377,7 +93404,7 @@ iteration 24: trace = 4.577894626572786 (4.46816e-11% change) Finished solving for bands 2 to 8 after 24 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.560518, 0.560561, 0.593296, 0.837451, 0.837595, 0.994129, 1.09832 -elapsed time for k point: 0.10354924201965332 +elapsed time for k point: 0.09605121612548828 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -93418,7 +93445,7 @@ iteration 18: trace = 4.546667003404457 (4.24489e-11% change) Finished solving for bands 1 to 8 after 18 iterations. tmfreqs:, 2, 0, 0.1, 0, 0.11547, 0.0711319, 0.538981, 0.559429, 0.617095, 0.834123, 0.839462, 0.988272, 1.08637 -elapsed time for k point: 0.10063910484313965 +elapsed time for k point: 0.09548091888427734 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -93453,7 +93480,7 @@ iteration 15: trace = 4.456771796562712 (4.07941e-11% change) Finished solving for bands 1 to 8 after 15 iterations. tmfreqs:, 3, 0, 0.2, 0, 0.23094, 0.138898, 0.508574, 0.556587, 0.65398, 0.825087, 0.84452, 0.968999, 1.05281 -elapsed time for k point: 0.08223342895507812 +elapsed time for k point: 0.080108642578125 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -93486,7 +93513,7 @@ iteration 14: trace = 4.364565233298257 (3.14404e-11% change) Finished solving for bands 1 to 8 after 14 iterations. tmfreqs:, 4, 0, 0.3, 0, 0.34641, 0.198939, 0.479631, 0.553145, 0.693119, 0.813353, 0.850964, 0.932869, 1.02598 -elapsed time for k point: 0.07584762573242188 +elapsed time for k point: 0.07603120803833008 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -93517,7 +93544,7 @@ iteration 13: trace = 4.304069964437605 (7.18538e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 5, 0, 0.4, 0, 0.46188, 0.244064, 0.4557, 0.550414, 0.730028, 0.80289, 0.856372, 0.891379, 1.01409 -elapsed time for k point: 0.0705559253692627 +elapsed time for k point: 0.09080052375793457 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -93548,7 +93575,7 @@ iteration 13: trace = 4.283477065616431 (4.14492e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 6, 0, 0.5, 0, 0.57735, 0.262015, 0.445331, 0.549383, 0.749186, 0.797864, 0.85849, 0.870609, 1.01087 -elapsed time for k point: 0.0708014965057373 +elapsed time for k point: 0.09143686294555664 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -93577,7 +93604,7 @@ iteration 12: trace = 4.264474631199774 (8.73084e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 7, -0.0666667, 0.466667, 0, 0.581187, 0.262984, 0.4475, 0.545804, 0.752448, 0.797093, 0.860461, 0.870245, 0.99895 -elapsed time for k point: 0.06511259078979492 +elapsed time for k point: 0.08326196670532227 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -93606,7 +93633,7 @@ iteration 12: trace = 4.228595652264469 (8.17059e-12% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 8, -0.133333, 0.433333, 0, 0.592546, 0.265671, 0.453801, 0.535912, 0.761319, 0.795166, 0.866056, 0.869135, 0.973413 -elapsed time for k point: 0.06534576416015625 +elapsed time for k point: 0.08363866806030273 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -93631,7 +93658,7 @@ iteration 10: trace = 4.196577821229713 (9.14088e-11% change) Finished solving for bands 1 to 8 after 10 iterations. tmfreqs:, 9, -0.2, 0.4, 0, 0.61101, 0.269404, 0.463648, 0.52172, 0.773443, 0.792931, 0.867201, 0.874681, 0.94487 -elapsed time for k point: 0.055045366287231445 +elapsed time for k point: 0.07011556625366211 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -93656,7 +93683,7 @@ iteration 10: trace = 4.175651761333514 (5.29421e-11% change) Finished solving for bands 1 to 8 after 10 iterations. tmfreqs:, 10, -0.266667, 0.366667, 0, 0.635959, 0.273, 0.476141, 0.505606, 0.78524, 0.791235, 0.864672, 0.885801, 0.918597 -elapsed time for k point: 0.055121660232543945 +elapsed time for k point: 0.07031393051147461 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -93679,7 +93706,7 @@ iteration 9: trace = 4.168411689609144 (8.91074e-11% change) Finished solving for bands 1 to 8 after 9 iterations. tmfreqs:, 11, -0.333333, 0.333333, 0, 0.666667, 0.27469, 0.489984, 0.490239, 0.79072, 0.790832, 0.863041, 0.899109, 0.89925 -elapsed time for k point: 0.05168271064758301 +elapsed time for k point: 0.06379127502441406 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -93706,7 +93733,7 @@ iteration 11: trace = 4.197854050309302 (1.33718e-11% change) Finished solving for bands 1 to 8 after 11 iterations. tmfreqs:, 12, -0.266667, 0.266667, 0, 0.533333, 0.2632, 0.47091, 0.51804, 0.764413, 0.795091, 0.864427, 0.896871, 0.932925 -elapsed time for k point: 0.06049060821533203 +elapsed time for k point: 0.07663488388061523 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -93735,7 +93762,7 @@ iteration 12: trace = 4.283266488990683 (1.11767e-11% change) Finished solving for bands 1 to 8 after 12 iterations. tmfreqs:, 13, -0.2, 0.2, 0, 0.4, 0.222593, 0.476537, 0.539917, 0.715636, 0.806516, 0.856013, 0.929969, 0.977199 -elapsed time for k point: 0.06554722785949707 +elapsed time for k point: 0.08348989486694336 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... linmin: converged after 4 iterations. @@ -93766,7 +93793,7 @@ iteration 13: trace = 4.410102274545241 (2.51947e-11% change) Finished solving for bands 1 to 8 after 13 iterations. tmfreqs:, 14, -0.133333, 0.133333, 0, 0.266667, 0.15856, 0.501245, 0.552927, 0.666818, 0.82116, 0.846938, 0.963589, 1.03113 -elapsed time for k point: 0.07385993003845215 +elapsed time for k point: 0.0901799201965332 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... linmin: converged after 5 iterations. @@ -93805,7 +93832,7 @@ iteration 17: trace = 4.534517622757202 (7.86028e-11% change) Finished solving for bands 1 to 8 after 17 iterations. tmfreqs:, 15, -0.0666667, 0.0666667, 0, 0.133333, 0.0819275, 0.534465, 0.558896, 0.622523, 0.832982, 0.840137, 0.98638, 1.08149 -elapsed time for k point: 0.0924539566040039 +elapsed time for k point: 0.11627435684204102 solve_kpoint (0,0,0): Solving for bands 2 to 8... linmin: converged after 4 iterations. @@ -93886,10 +93913,10 @@ AssertionError: -0.9945407488966614 != -0.9950905165813236 within 3 places (0.0005497676846621946 difference) ---------------------------------------------------------------------- -Ran 47 tests in 345.794s +Ran 47 tests in 394.818s FAILED (failures=4) -elapsed time for k point: 0.06440520286560059 +elapsed time for k point: 0.10200309753417969 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.2746902258623629 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> Band 2 range: 0.44533108084715833 at Vector3<0.0, 0.5, 0.0> to 0.5605181423162844 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.49023891490276683 at Vector3<-0.3333333333333333, 0.3333333333333333, 0.0> to 0.5605607947797748 at Vector3<0.0, 0.0, 0.0> @@ -93903,39 +93930,39 @@ Gap from band 4 (0.79071959744437) to band 5 (0.7908320763327578), 0.014223865113315824% Gap from band 5 (0.8374511167537574) to band 6 (0.8375948528443271), 0.01716204727255483% Gap from band 6 (0.8672009264903449) to band 7 (0.8691349955739198), 0.2227759109280675% -total elapsed time for run: 1.1564381122589111 +total elapsed time for run: 1.3739757537841797 done -/tmp/meepWcFBDI/test_triangular_lattice-0: 1.16s +/tmp/meephWM0hz/test_triangular_lattice-0: 1.38s -/tmp/meepWcFBDI/test_update_band_range_data-0 +/tmp/meephWM0hz/test_update_band_range_data-0 ======================== -/tmp/meepWcFBDI/test_update_band_range_data-0: 0.00s +/tmp/meephWM0hz/test_update_band_range_data-0: 0.00s -Elapsed run time = 345.8169 s +Elapsed run time = 394.8463 s FAIL tests/test_mpb.py (exit status: 1) FAIL: tests/test_multilevel_atom ================================ -Matplotlib created a temporary cache directory at /tmp/matplotlib-fel7zrxd because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-63ohhxyx because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. ----------- Initializing structure... -time for choose_chunkdivision = 3.69633e-05 s +time for choose_chunkdivision = 6.6994e-05 s Working in 1D dimensions. Computational cell is 0 x 0 x 3 with resolution 40 block, center = (0,0,-1) size (1e+20,1e+20,1) axes (1,0,0), (0,1,0), (0,0,1) dielectric constant epsilon diagonal = (2.25,2.25,2.25) -time for set_epsilon = 9.9111e-05 s +time for set_epsilon = 0.000124961 s multilevel atom susceptibility ----------- -Meep progress: 2322.8625/7000.0 = 33.2% done in 4.0s, 8.1s to go -on time step 185829 (time=2322.86), 2.15254e-05 s/step -Meep progress: 4607.775000000001/7000.0 = 65.8% done in 8.0s, 4.2s to go -on time step 368625 (time=4607.81), 2.18824e-05 s/step -Meep progress: 6913.125/7000.0 = 98.8% done in 12.0s, 0.2s to go -on time step 553054 (time=6913.18), 2.16886e-05 s/step +Meep progress: 1475.4375/7000.0 = 21.1% done in 4.0s, 15.0s to go +on time step 118035 (time=1475.44), 3.38886e-05 s/step +Meep progress: 3330.6125/7000.0 = 47.6% done in 8.0s, 8.8s to go +on time step 266452 (time=3330.65), 2.69511e-05 s/step +Meep progress: 5393.4375/7000.0 = 77.0% done in 12.0s, 3.6s to go +on time step 431480 (time=5393.5), 2.42384e-05 s/step F ====================================================================== FAIL: test_multilevel_atom (__main__.TestMultiLevelAtom.test_multilevel_atom) @@ -93958,11 +93985,11 @@ AssertionError: 4.458595015523278 != -2.7110969214986387 within 7 places (7.169691937021916 difference) ---------------------------------------------------------------------- -Ran 1 test in 12.158s +Ran 1 test in 15.435s FAILED (failures=1) -Elapsed run time = 12.1594 s +Elapsed run time = 15.4370 s FAIL tests/test_multilevel_atom.py (exit status: 1) FAIL: tests/test_refl_angular @@ -93977,11 +94004,11 @@ FAIL: tests/test_ring ===================== -Matplotlib created a temporary cache directory at /tmp/matplotlib-3s58sd0u because the default path (/nonexistent/first-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. +Matplotlib created a temporary cache directory at /tmp/matplotlib-jw8wa2lt because the default path (/nonexistent/second-build/.config/matplotlib) is not a writable directory; it is highly recommended to set the MPLCONFIGDIR environment variable to a writable directory, in particular to speed up the import of Matplotlib and to better support multiprocessing. ----------- Initializing structure... Halving computational cell along direction y -time for choose_chunkdivision = 0.000166961 s +time for choose_chunkdivision = 0.000312929 s Working in 2D dimensions. Computational cell is 16 x 16 x 0 with resolution 10 cylinder, center = (0,0,0) @@ -93990,10 +94017,10 @@ cylinder, center = (0,0,0) radius 1, height 1e+20, axis (0, 0, 1) dielectric constant epsilon diagonal = (1,1,1) -time for set_epsilon = 0.0617641 s +time for set_epsilon = 0.0865541 s ----------- -Meep: using output directory '/tmp/meepJ2O8CQ' -creating output file "/tmp/meepJ2O8CQ/test_ring-eps-000000.00.h5"... +Meep: using output directory '/tmp/meepKs7N4H' +creating output file "/tmp/meepKs7N4H/test_ring-eps-000000.00.h5"... F ====================================================================== FAIL: test_harminv (__main__.TestRing.test_harminv) @@ -94004,7 +94031,7 @@ AssertionError: 0.0034940920329178107 != 0.00341267634436 within 4 places (8.141568855781064e-05 difference) ---------------------------------------------------------------------- -Ran 1 test in 1.415s +Ran 1 test in 1.935s FAILED (failures=1) harminv0:, frequency, imag. freq., Q, |amp|, amplitude, error @@ -94013,7 +94040,7 @@ harminv0:, 0.1752466531330348, -4.875157487167941e-05, 1797.3435073052221, 0.007186041459138177, -0.0008190310310293238-0.007139214244065223i, 1.4536448405586033e-07+0.0i run 0 finished at t = 400.0 (8000 timesteps) -Elapsed run time = 1.4169 s +Elapsed run time = 1.9371 s FAIL tests/test_ring.py (exit status: 1) FAIL: tests/test_special_kz @@ -94051,7 +94078,7 @@ make[5]: Entering directory '/build/reproducible-path/meep-1.25.0/src' make[6]: Entering directory '/build/reproducible-path/meep-1.25.0/src' /usr/bin/mkdir -p '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu' - /bin/bash ../libtool --mode=install /usr/bin/install -c libmeep.la '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu' + /bin/sh ../libtool --mode=install /usr/bin/install -c libmeep.la '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu' libtool: install: /usr/bin/install -c .libs/libmeep.so.30.0.0 /build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu/libmeep.so.30.0.0 libtool: install: (cd /build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu && { ln -s -f libmeep.so.30.0.0 libmeep.so.30 || { rm -f libmeep.so.30 && ln -s libmeep.so.30.0.0 libmeep.so.30; }; }) libtool: install: (cd /build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu && { ln -s -f libmeep.so.30.0.0 libmeep.so || { rm -f libmeep.so && ln -s libmeep.so.30.0.0 libmeep.so; }; }) @@ -94081,7 +94108,7 @@ make[4]: Entering directory '/build/reproducible-path/meep-1.25.0/scheme' make[5]: Entering directory '/build/reproducible-path/meep-1.25.0/scheme' /usr/bin/mkdir -p '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/bin' - /bin/bash ../libtool --mode=install /usr/bin/install -c meep '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/bin' + /bin/sh ../libtool --mode=install /usr/bin/install -c meep '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/bin' libtool: warning: '../src/libmeep.la' has not been installed in '/usr/lib/i386-linux-gnu' libtool: install: /usr/bin/install -c .libs/meep /build/reproducible-path/meep-1.25.0/debian/tmp/usr/bin/meep /usr/bin/mkdir -p '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/share/meep' @@ -94093,9 +94120,9 @@ make[3]: Entering directory '/build/reproducible-path/meep-1.25.0/libpympb' make[4]: Entering directory '/build/reproducible-path/meep-1.25.0/libpympb' /usr/bin/mkdir -p '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu' - /bin/bash ../libtool --mode=install /usr/bin/install -c libpympb.la '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu' + /bin/sh ../libtool --mode=install /usr/bin/install -c libpympb.la '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu' libtool: warning: relinking 'libpympb.la' -libtool: install: (cd /build/reproducible-path/meep-1.25.0/libpympb; /bin/bash "/build/reproducible-path/meep-1.25.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libpympb.la -rpath /usr/lib/i386-linux-gnu libpympb_la-pympb.lo ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/reproducible-path/meep-1.25.0/debian/tmp) +libtool: install: (cd /build/reproducible-path/meep-1.25.0/libpympb; /bin/sh "/build/reproducible-path/meep-1.25.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libpympb.la -rpath /usr/lib/i386-linux-gnu libpympb_la-pympb.lo ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/reproducible-path/meep-1.25.0/debian/tmp) libtool: relink: i686-linux-gnu-g++ -fPIC -DPIC -shared -nostdlib /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/14/crtbeginS.o .libs/libpympb_la-pympb.o -L/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu -L/usr/lib/i386-linux-gnu -lmeep -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/14/crtendS.o /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crtn.o -g -O2 -fstack-protector-strong -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -Wl,-soname -Wl,libpympb.so.30 -o .libs/libpympb.so.30.0.0 libtool: install: /usr/bin/install -c .libs/libpympb.so.30.0.0T /build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu/libpympb.so.30.0.0 libtool: install: (cd /build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu && { ln -s -f libpympb.so.30.0.0 libpympb.so.30 || { rm -f libpympb.so.30 && ln -s libpympb.so.30.0.0 libpympb.so.30; }; }) @@ -94115,9 +94142,9 @@ make[4]: Entering directory '/build/reproducible-path/meep-1.25.0/python' make[5]: Entering directory '/build/reproducible-path/meep-1.25.0/python' /usr/bin/mkdir -p '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/python3.12/site-packages/meep' - /bin/bash ../libtool --mode=install /usr/bin/install -c _meep.la '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/python3.12/site-packages/meep' + /bin/sh ../libtool --mode=install /usr/bin/install -c _meep.la '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/python3.12/site-packages/meep' libtool: warning: relinking '_meep.la' -libtool: install: (cd /build/reproducible-path/meep-1.25.0/python; /bin/bash "/build/reproducible-path/meep-1.25.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _meep.la -rpath /usr/lib/python3.12/site-packages/meep _meep_la-meep-python.lo ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/reproducible-path/meep-1.25.0/debian/tmp) +libtool: install: (cd /build/reproducible-path/meep-1.25.0/python; /bin/sh "/build/reproducible-path/meep-1.25.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _meep.la -rpath /usr/lib/python3.12/site-packages/meep _meep_la-meep-python.lo ../src/libmeep.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/reproducible-path/meep-1.25.0/debian/tmp) libtool: relink: i686-linux-gnu-g++ -fPIC -DPIC -shared -nostdlib /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/14/crtbeginS.o .libs/_meep_la-meep-python.o -L/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu -L/usr/lib/i386-linux-gnu -lmeep -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/14/crtendS.o /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crtn.o -g -O2 -fstack-protector-strong -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -Wl,-soname -Wl,_meep.so.30 -o .libs/_meep.so.30.0.0 libtool: install: /usr/bin/install -c .libs/_meep.so.30.0.0T /build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/python3.12/site-packages/meep/_meep.so.30.0.0 libtool: install: (cd /build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/python3.12/site-packages/meep && { ln -s -f _meep.so.30.0.0 _meep.so.30 || { rm -f _meep.so.30 && ln -s _meep.so.30.0.0 _meep.so.30; }; }) @@ -94140,9 +94167,9 @@ Byte-compiling python modules (optimized versions) ... __init__.pybinary_partition_utils.pychunk_balancer.pygeom.pysimulation.pysource.pytiming_measurements.pyvisualization.pymaterials.pyverbosity_mgr.py /usr/bin/mkdir -p '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/python3.12/site-packages/meep/mpb' - /bin/bash ../libtool --mode=install /usr/bin/install -c _mpb.la '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/python3.12/site-packages/meep/mpb' + /bin/sh ../libtool --mode=install /usr/bin/install -c _mpb.la '/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/python3.12/site-packages/meep/mpb' libtool: warning: relinking '_mpb.la' -libtool: install: (cd /build/reproducible-path/meep-1.25.0/python; /bin/bash "/build/reproducible-path/meep-1.25.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _mpb.la -rpath /usr/lib/python3.12/site-packages/meep/mpb _mpb_la-mpb-python.lo ../libpympb/libpympb.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/reproducible-path/meep-1.25.0/debian/tmp) +libtool: install: (cd /build/reproducible-path/meep-1.25.0/python; /bin/sh "/build/reproducible-path/meep-1.25.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/reproducible-path/meep-1.25.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 30:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _mpb.la -rpath /usr/lib/python3.12/site-packages/meep/mpb _mpb_la-mpb-python.lo ../libpympb/libpympb.la -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lblas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/reproducible-path/meep-1.25.0/debian/tmp) libtool: relink: i686-linux-gnu-g++ -fPIC -DPIC -shared -nostdlib /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/14/crtbeginS.o .libs/_mpb_la-mpb-python.o -L/build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/i386-linux-gnu -L/usr/lib/i386-linux-gnu -lpympb -lGDSII -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lblas -L/usr/lib/gcc/i686-linux-gnu/14 -L/usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/14/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/14/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/14/crtendS.o /usr/lib/gcc/i686-linux-gnu/14/../../../i386-linux-gnu/crtn.o -g -O2 -fstack-protector-strong -Wl,-z -Wl,relro -Wl,-z -Wl,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -Wl,-soname -Wl,_mpb.so.30 -o .libs/_mpb.so.30.0.0 libtool: install: /usr/bin/install -c .libs/_mpb.so.30.0.0T /build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/python3.12/site-packages/meep/mpb/_mpb.so.30.0.0 libtool: install: (cd /build/reproducible-path/meep-1.25.0/debian/tmp/usr/lib/python3.12/site-packages/meep/mpb && { ln -s -f _mpb.so.30.0.0 _mpb.so.30 || { rm -f _mpb.so.30 && ln -s _mpb.so.30.0.0 _mpb.so.30; }; }) @@ -94204,18 +94231,18 @@ dh_strip -a dh_makeshlibs -a dh_shlibdeps -a -dpkg-shlibdeps: warning: debian/python3-meep/usr/lib/python3/dist-packages/meep/_meep.so.30.0.0 contains an unresolvable reference to symbol PyModule_GetDict: it's probably a plugin -dpkg-shlibdeps: warning: 107 other similar warnings have been skipped (use -v to see them all) -dpkg-shlibdeps: warning: debian/python3-meep/usr/lib/python3/dist-packages/meep/mpb/_mpb.so.30.0.0 contains an unresolvable reference to symbol _ZN9meep_geom14vector3_to_vecE7vector3: it's probably a plugin +dpkg-shlibdeps: warning: debian/python3-meep/usr/lib/python3/dist-packages/meep/mpb/_mpb.so.30.0.0 contains an unresolvable reference to symbol PyErr_Fetch: it's probably a plugin dpkg-shlibdeps: warning: 97 other similar warnings have been skipped (use -v to see them all) +dpkg-shlibdeps: warning: debian/python3-meep/usr/lib/python3/dist-packages/meep/_meep.so.30.0.0 contains an unresolvable reference to symbol PyObject_SetAttrString: it's probably a plugin +dpkg-shlibdeps: warning: 107 other similar warnings have been skipped (use -v to see them all) dh_installdeb dh_gencontrol dh_md5sums dh_builddeb +dpkg-deb: building package 'python3-meep-dbgsym' in '../python3-meep-dbgsym_1.25.0-4_i386.deb'. dpkg-deb: building package 'meep' in '../meep_1.25.0-4_i386.deb'. dpkg-deb: building package 'libmeep-dev' in '../libmeep-dev_1.25.0-4_i386.deb'. dpkg-deb: building package 'libmeep30' in '../libmeep30_1.25.0-4_i386.deb'. -dpkg-deb: building package 'python3-meep-dbgsym' in '../python3-meep-dbgsym_1.25.0-4_i386.deb'. dpkg-deb: building package 'meep-dbgsym' in '../meep-dbgsym_1.25.0-4_i386.deb'. dpkg-deb: building package 'libmeep30-dbgsym' in '../libmeep30-dbgsym_1.25.0-4_i386.deb'. dpkg-deb: building package 'python3-meep' in '../python3-meep_1.25.0-4_i386.deb'. @@ -94226,12 +94253,14 @@ dpkg-buildpackage: info: binary-only upload (no source included) dpkg-genchanges: info: not including original source code in upload I: copying local configuration +I: user script /srv/workspace/pbuilder/3784/tmp/hooks/B01_cleanup starting +I: user script /srv/workspace/pbuilder/3784/tmp/hooks/B01_cleanup finished I: unmounting dev/ptmx filesystem I: unmounting dev/pts filesystem I: unmounting dev/shm filesystem I: unmounting proc filesystem I: unmounting sys filesystem I: cleaning the build env -I: removing directory /srv/workspace/pbuilder/6922 and its subdirectories -I: Current time: Fri Nov 28 08:12:15 -12 2025 -I: pbuilder-time-stamp: 1764360735 +I: removing directory /srv/workspace/pbuilder/3784 and its subdirectories +I: Current time: Sun Oct 27 04:41:03 +14 2024 +I: pbuilder-time-stamp: 1729953663