Diff of the two buildlogs: -- --- b1/build.log 2020-08-31 07:37:08.487934634 +0000 +++ b2/build.log 2020-08-31 08:33:40.771800999 +0000 @@ -1,6 +1,6 @@ I: pbuilder: network access will be disabled during build -I: Current time: Sun Oct 3 01:38:07 -12 2021 -I: pbuilder-time-stamp: 1633268287 +I: Current time: Mon Aug 31 21:37:19 +14 2020 +I: pbuilder-time-stamp: 1598859439 I: Building the build Environment I: extracting base tarball [/var/cache/pbuilder/buster-reproducible-base.tgz] I: copying local configuration @@ -18,7 +18,7 @@ I: Extracting source gpgv: unknown type of key resource 'trustedkeys.kbx' gpgv: keyblock resource '/root/.gnupg/trustedkeys.kbx': General error -gpgv: Signature made Tue Feb 5 01:00:49 2019 -12 +gpgv: Signature made Wed Feb 6 03:00:49 2019 +14 gpgv: using RSA key 6201FBFFDBBDE07822EABB9696FCAC0D387B5847 gpgv: issuer "debian@alteholz.de" gpgv: Can't check signature: No public key @@ -32,138 +32,172 @@ dpkg-source: info: applying libgeom-fix-include.patch I: using fakeroot in build. I: Installing the build-deps -I: user script /srv/workspace/pbuilder/15499/tmp/hooks/D02_print_environment starting +I: user script /srv/workspace/pbuilder/732/tmp/hooks/D01_modify_environment starting +debug: Running on profitbricks-build12-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 +Removing 'diversion of /bin/sh to /bin/sh.distrib by dash' +Adding 'diversion of /bin/sh to /bin/sh.distrib by bash' +Removing 'diversion of /usr/share/man/man1/sh.1.gz to /usr/share/man/man1/sh.distrib.1.gz by dash' +Adding 'diversion of /usr/share/man/man1/sh.1.gz to /usr/share/man/man1/sh.distrib.1.gz by 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/732/tmp/hooks/D01_modify_environment finished +I: user script /srv/workspace/pbuilder/732/tmp/hooks/D02_print_environment starting I: set - BUILDDIR='/build' - 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=18' - DISTRIBUTION='' - HOME='/root' - HOST_ARCH='i386' + BASH=/bin/sh + BASHOPTS=checkwinsize:cmdhist:complete_fullquote:extquote:force_fignore:globasciiranges:hostcomplete:interactive_comments:progcomp:promptvars:sourcepath + BASH_ALIASES=() + BASH_ARGC=() + BASH_ARGV=() + BASH_CMDS=() + BASH_LINENO=([0]="12" [1]="0") + BASH_SOURCE=([0]="/tmp/hooks/D02_print_environment" [1]="/tmp/hooks/D02_print_environment") + BASH_VERSINFO=([0]="5" [1]="0" [2]="3" [3]="1" [4]="release" [5]="i686-pc-linux-gnu") + BASH_VERSION='5.0.3(1)-release' + BUILDDIR=/build + 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=10' + DIRSTACK=() + DISTRIBUTION= + EUID=0 + FUNCNAME=([0]="Echo" [1]="main") + GROUPS=() + HOME=/root + HOSTNAME=i-capture-the-hostname + HOSTTYPE=i686 + HOST_ARCH=i386 IFS=' ' - INVOCATION_ID='8586d3f1fccd49acaad268bca0d925fb' - 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='15499' - PS1='# ' - PS2='> ' + INVOCATION_ID=39ea75727ecd46b28eff0119c1392b7e + 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=732 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/tmp.s5L1Ks2Xef/pbuilderrc_GLf4 --hookdir /etc/pbuilder/first-build-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/buster-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/tmp.s5L1Ks2Xef/b1 --logfile b1/build.log meep_1.7.0-3.dsc' - SUDO_GID='112' - SUDO_UID='107' - SUDO_USER='jenkins' - TERM='unknown' - TZ='/usr/share/zoneinfo/Etc/GMT+12' - USER='root' - _='/usr/bin/systemd-run' - http_proxy='http://85.184.249.68:3128' + 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/tmp.s5L1Ks2Xef/pbuilderrc_Vjdw --hookdir /etc/pbuilder/rebuild-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/buster-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/tmp.s5L1Ks2Xef/b2 --logfile b2/build.log meep_1.7.0-3.dsc' + SUDO_GID=112 + SUDO_UID=107 + SUDO_USER=jenkins + TERM=unknown + TZ=/usr/share/zoneinfo/Etc/GMT-14 + UID=0 + USER=root + _='I: set' + http_proxy=http://78.137.99.97:3128 I: uname -a - Linux profitbricks-build6-i386 4.19.0-10-amd64 #1 SMP Debian 4.19.132-1 (2020-07-24) x86_64 GNU/Linux + Linux i-capture-the-hostname 4.19.0-10-686-pae #1 SMP Debian 4.19.132-1 (2020-07-24) i686 GNU/Linux I: ls -l /bin - total 5476 - -rwxr-xr-x 1 root root 1302248 Apr 17 2019 bash - -rwxr-xr-x 3 root root 38280 Jul 10 2019 bunzip2 - -rwxr-xr-x 3 root root 38280 Jul 10 2019 bzcat - lrwxrwxrwx 1 root root 6 Jul 10 2019 bzcmp -> bzdiff - -rwxr-xr-x 1 root root 2227 Jul 10 2019 bzdiff - lrwxrwxrwx 1 root root 6 Jul 10 2019 bzegrep -> bzgrep - -rwxr-xr-x 1 root root 4877 Jun 24 2019 bzexe - lrwxrwxrwx 1 root root 6 Jul 10 2019 bzfgrep -> bzgrep - -rwxr-xr-x 1 root root 3641 Jul 10 2019 bzgrep - -rwxr-xr-x 3 root root 38280 Jul 10 2019 bzip2 - -rwxr-xr-x 1 root root 17768 Jul 10 2019 bzip2recover - lrwxrwxrwx 1 root root 6 Jul 10 2019 bzless -> bzmore - -rwxr-xr-x 1 root root 1297 Jul 10 2019 bzmore - -rwxr-xr-x 1 root root 38692 Feb 28 2019 cat - -rwxr-xr-x 1 root root 75588 Feb 28 2019 chgrp - -rwxr-xr-x 1 root root 63268 Feb 28 2019 chmod - -rwxr-xr-x 1 root root 75588 Feb 28 2019 chown - -rwxr-xr-x 1 root root 153732 Feb 28 2019 cp - -rwxr-xr-x 1 root root 132820 Jan 17 2019 dash - -rwxr-xr-x 1 root root 120676 Feb 28 2019 date - -rwxr-xr-x 1 root root 92040 Feb 28 2019 dd - -rwxr-xr-x 1 root root 100620 Feb 28 2019 df - -rwxr-xr-x 1 root root 149736 Feb 28 2019 dir - -rwxr-xr-x 1 root root 79412 Jan 9 2019 dmesg - lrwxrwxrwx 1 root root 8 Sep 26 2018 dnsdomainname -> hostname - lrwxrwxrwx 1 root root 8 Sep 26 2018 domainname -> hostname - -rwxr-xr-x 1 root root 34532 Feb 28 2019 echo - -rwxr-xr-x 1 root root 28 Jan 7 2019 egrep - -rwxr-xr-x 1 root root 34532 Feb 28 2019 false - -rwxr-xr-x 1 root root 28 Jan 7 2019 fgrep - -rwxr-xr-x 1 root root 67700 Jan 9 2019 findmnt - -rwsr-xr-x 1 root root 30112 Apr 22 2020 fusermount - -rwxr-xr-x 1 root root 206392 Jan 7 2019 grep - -rwxr-xr-x 2 root root 2345 Jan 5 2019 gunzip - -rwxr-xr-x 1 root root 6375 Jan 5 2019 gzexe - -rwxr-xr-x 1 root root 100952 Jan 5 2019 gzip - -rwxr-xr-x 1 root root 21916 Sep 26 2018 hostname - -rwxr-xr-x 1 root root 79752 Feb 28 2019 ln - -rwxr-xr-x 1 root root 55400 Jul 26 2018 login - -rwxr-xr-x 1 root root 149736 Feb 28 2019 ls - -rwxr-xr-x 1 root root 112032 Jan 9 2019 lsblk - -rwxr-xr-x 1 root root 87972 Feb 28 2019 mkdir - -rwxr-xr-x 1 root root 79748 Feb 28 2019 mknod - -rwxr-xr-x 1 root root 46916 Feb 28 2019 mktemp - -rwxr-xr-x 1 root root 42348 Jan 9 2019 more - -rwsr-xr-x 1 root root 50592 Jan 9 2019 mount - -rwxr-xr-x 1 root root 13724 Jan 9 2019 mountpoint - -rwxr-xr-x 1 root root 157832 Feb 28 2019 mv - lrwxrwxrwx 1 root root 8 Sep 26 2018 nisdomainname -> hostname - lrwxrwxrwx 1 root root 14 Feb 14 2019 pidof -> /sbin/killall5 - -rwxr-xr-x 1 root root 38660 Feb 28 2019 pwd - lrwxrwxrwx 1 root root 4 Apr 17 2019 rbash -> bash - -rwxr-xr-x 1 root root 46852 Feb 28 2019 readlink - -rwxr-xr-x 1 root root 75588 Feb 28 2019 rm - -rwxr-xr-x 1 root root 42756 Feb 28 2019 rmdir - -rwxr-xr-x 1 root root 22276 Jan 21 2019 run-parts - -rwxr-xr-x 1 root root 125036 Dec 22 2018 sed - lrwxrwxrwx 1 root root 4 Sep 26 02:47 sh -> dash - -rwxr-xr-x 1 root root 34532 Feb 28 2019 sleep - -rwxr-xr-x 1 root root 79652 Feb 28 2019 stty - -rwsr-xr-x 1 root root 71072 Jan 9 2019 su - -rwxr-xr-x 1 root root 34564 Feb 28 2019 sync - -rwxr-xr-x 1 root root 504024 Apr 23 2019 tar - -rwxr-xr-x 1 root root 13860 Jan 21 2019 tempfile - -rwxr-xr-x 1 root root 104292 Feb 28 2019 touch - -rwxr-xr-x 1 root root 34532 Feb 28 2019 true - -rwxr-xr-x 1 root root 17768 Apr 22 2020 ulockmgr_server - -rwsr-xr-x 1 root root 30108 Jan 9 2019 umount - -rwxr-xr-x 1 root root 34532 Feb 28 2019 uname - -rwxr-xr-x 2 root root 2345 Jan 5 2019 uncompress - -rwxr-xr-x 1 root root 149736 Feb 28 2019 vdir - -rwxr-xr-x 1 root root 34208 Jan 9 2019 wdctl - -rwxr-xr-x 1 root root 946 Jan 21 2019 which - lrwxrwxrwx 1 root root 8 Sep 26 2018 ypdomainname -> hostname - -rwxr-xr-x 1 root root 1983 Jan 5 2019 zcat - -rwxr-xr-x 1 root root 1677 Jan 5 2019 zcmp - -rwxr-xr-x 1 root root 5879 Jan 5 2019 zdiff - -rwxr-xr-x 1 root root 29 Jan 5 2019 zegrep - -rwxr-xr-x 1 root root 29 Jan 5 2019 zfgrep - -rwxr-xr-x 1 root root 2080 Jan 5 2019 zforce - -rwxr-xr-x 1 root root 7584 Jan 5 2019 zgrep - -rwxr-xr-x 1 root root 2205 Jan 5 2019 zless - -rwxr-xr-x 1 root root 1841 Jan 5 2019 zmore - -rwxr-xr-x 1 root root 4552 Jan 5 2019 znew -I: user script /srv/workspace/pbuilder/15499/tmp/hooks/D02_print_environment finished + total 5496 + -rwxr-xr-x 1 root root 1302248 Apr 18 2019 bash + -rwxr-xr-x 3 root root 38280 Jul 11 2019 bunzip2 + -rwxr-xr-x 3 root root 38280 Jul 11 2019 bzcat + lrwxrwxrwx 1 root root 6 Jul 11 2019 bzcmp -> bzdiff + -rwxr-xr-x 1 root root 2227 Jul 11 2019 bzdiff + lrwxrwxrwx 1 root root 6 Jul 11 2019 bzegrep -> bzgrep + -rwxr-xr-x 1 root root 4877 Jun 25 2019 bzexe + lrwxrwxrwx 1 root root 6 Jul 11 2019 bzfgrep -> bzgrep + -rwxr-xr-x 1 root root 3641 Jul 11 2019 bzgrep + -rwxr-xr-x 3 root root 38280 Jul 11 2019 bzip2 + -rwxr-xr-x 1 root root 17768 Jul 11 2019 bzip2recover + lrwxrwxrwx 1 root root 6 Jul 11 2019 bzless -> bzmore + -rwxr-xr-x 1 root root 1297 Jul 11 2019 bzmore + -rwxr-xr-x 1 root root 38692 Mar 1 2019 cat + -rwxr-xr-x 1 root root 75588 Mar 1 2019 chgrp + -rwxr-xr-x 1 root root 63268 Mar 1 2019 chmod + -rwxr-xr-x 1 root root 75588 Mar 1 2019 chown + -rwxr-xr-x 1 root root 153732 Mar 1 2019 cp + -rwxr-xr-x 1 root root 132820 Jan 18 2019 dash + -rwxr-xr-x 1 root root 120676 Mar 1 2019 date + -rwxr-xr-x 1 root root 92040 Mar 1 2019 dd + -rwxr-xr-x 1 root root 100620 Mar 1 2019 df + -rwxr-xr-x 1 root root 149736 Mar 1 2019 dir + -rwxr-xr-x 1 root root 79412 Jan 10 2019 dmesg + lrwxrwxrwx 1 root root 8 Sep 27 2018 dnsdomainname -> hostname + lrwxrwxrwx 1 root root 8 Sep 27 2018 domainname -> hostname + -rwxr-xr-x 1 root root 34532 Mar 1 2019 echo + -rwxr-xr-x 1 root root 28 Jan 8 2019 egrep + -rwxr-xr-x 1 root root 34532 Mar 1 2019 false + -rwxr-xr-x 1 root root 28 Jan 8 2019 fgrep + -rwxr-xr-x 1 root root 67700 Jan 10 2019 findmnt + -rwsr-xr-x 1 root root 30112 Apr 23 09:38 fusermount + -rwxr-xr-x 1 root root 206392 Jan 8 2019 grep + -rwxr-xr-x 2 root root 2345 Jan 6 2019 gunzip + -rwxr-xr-x 1 root root 6375 Jan 6 2019 gzexe + -rwxr-xr-x 1 root root 100952 Jan 6 2019 gzip + -rwxr-xr-x 1 root root 21916 Sep 27 2018 hostname + -rwxr-xr-x 1 root root 79752 Mar 1 2019 ln + -rwxr-xr-x 1 root root 55400 Jul 27 2018 login + -rwxr-xr-x 1 root root 149736 Mar 1 2019 ls + -rwxr-xr-x 1 root root 112032 Jan 10 2019 lsblk + -rwxr-xr-x 1 root root 87972 Mar 1 2019 mkdir + -rwxr-xr-x 1 root root 79748 Mar 1 2019 mknod + -rwxr-xr-x 1 root root 46916 Mar 1 2019 mktemp + -rwxr-xr-x 1 root root 42348 Jan 10 2019 more + -rwsr-xr-x 1 root root 50592 Jan 10 2019 mount + -rwxr-xr-x 1 root root 13724 Jan 10 2019 mountpoint + -rwxr-xr-x 1 root root 157832 Mar 1 2019 mv + lrwxrwxrwx 1 root root 8 Sep 27 2018 nisdomainname -> hostname + lrwxrwxrwx 1 root root 14 Feb 15 2019 pidof -> /sbin/killall5 + -rwxr-xr-x 1 root root 38660 Mar 1 2019 pwd + lrwxrwxrwx 1 root root 4 Apr 18 2019 rbash -> bash + -rwxr-xr-x 1 root root 46852 Mar 1 2019 readlink + -rwxr-xr-x 1 root root 75588 Mar 1 2019 rm + -rwxr-xr-x 1 root root 42756 Mar 1 2019 rmdir + -rwxr-xr-x 1 root root 22276 Jan 22 2019 run-parts + -rwxr-xr-x 1 root root 125036 Dec 23 2018 sed + lrwxrwxrwx 1 root root 4 Aug 31 21:39 sh -> bash + lrwxrwxrwx 1 root root 4 Aug 24 22:27 sh.distrib -> dash + -rwxr-xr-x 1 root root 34532 Mar 1 2019 sleep + -rwxr-xr-x 1 root root 79652 Mar 1 2019 stty + -rwsr-xr-x 1 root root 71072 Jan 10 2019 su + -rwxr-xr-x 1 root root 34564 Mar 1 2019 sync + -rwxr-xr-x 1 root root 504024 Apr 24 2019 tar + -rwxr-xr-x 1 root root 13860 Jan 22 2019 tempfile + -rwxr-xr-x 1 root root 104292 Mar 1 2019 touch + -rwxr-xr-x 1 root root 34532 Mar 1 2019 true + -rwxr-xr-x 1 root root 17768 Apr 23 09:38 ulockmgr_server + -rwsr-xr-x 1 root root 30108 Jan 10 2019 umount + -rwxr-xr-x 1 root root 34532 Mar 1 2019 uname + -rwxr-xr-x 2 root root 2345 Jan 6 2019 uncompress + -rwxr-xr-x 1 root root 149736 Mar 1 2019 vdir + -rwxr-xr-x 1 root root 34208 Jan 10 2019 wdctl + -rwxr-xr-x 1 root root 946 Jan 22 2019 which + lrwxrwxrwx 1 root root 8 Sep 27 2018 ypdomainname -> hostname + -rwxr-xr-x 1 root root 1983 Jan 6 2019 zcat + -rwxr-xr-x 1 root root 1677 Jan 6 2019 zcmp + -rwxr-xr-x 1 root root 5879 Jan 6 2019 zdiff + -rwxr-xr-x 1 root root 29 Jan 6 2019 zegrep + -rwxr-xr-x 1 root root 29 Jan 6 2019 zfgrep + -rwxr-xr-x 1 root root 2080 Jan 6 2019 zforce + -rwxr-xr-x 1 root root 7584 Jan 6 2019 zgrep + -rwxr-xr-x 1 root root 2205 Jan 6 2019 zless + -rwxr-xr-x 1 root root 1841 Jan 6 2019 zmore + -rwxr-xr-x 1 root root 4552 Jan 6 2019 znew +I: user script /srv/workspace/pbuilder/732/tmp/hooks/D02_print_environment finished -> Attempting to satisfy build-dependencies -> Creating pbuilder-satisfydepends-dummy package Package: pbuilder-satisfydepends-dummy @@ -367,7 +401,7 @@ Get: 130 http://deb.debian.org/debian buster/main i386 python-scipy i386 1.1.0-7 [9280 kB] Get: 131 http://deb.debian.org/debian buster/main i386 swig3.0 i386 3.0.12-2 [1456 kB] Get: 132 http://deb.debian.org/debian buster/main i386 swig i386 3.0.12-2 [310 kB] -Fetched 122 MB in 2s (51.2 MB/s) +Fetched 122 MB in 14s (8979 kB/s) debconf: delaying package configuration, since apt-utils is not installed Selecting previously unselected package libbsd0: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 ... 19234 files and directories currently installed.) @@ -930,7 +964,7 @@ fakeroot is already the newest version (1.23-1). 0 upgraded, 0 newly installed, 0 to remove and 0 not upgraded. I: Building the package -I: Running cd /build/meep-1.7.0/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-buildpackage -us -uc -b +I: Running cd /build/meep-1.7.0/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-buildpackage -us -uc -b dpkg-buildpackage: info: source package meep dpkg-buildpackage: info: source version 1.7.0-3 dpkg-buildpackage: info: source distribution sid @@ -1178,7 +1212,7 @@ configure: WARNING: unrecognized options: --enable-cxx make[1]: Leaving directory '/build/meep-1.7.0' dh_auto_build - make -j18 + make -j10 make[1]: Entering directory '/build/meep-1.7.0' make all-recursive make[2]: Entering directory '/build/meep-1.7.0' @@ -1189,55 +1223,32 @@ make[4]: Entering directory '/build/meep-1.7.0/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 -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/meep-1.7.0=. -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 -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -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 -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath make[4]: Leaving directory '/build/meep-1.7.0/src' (echo "/* This file was automatically generated --- DO NOT EDIT */"; echo; ../src/sphere_quad) > sphere-quad.h make all-am make[4]: Entering directory '/build/meep-1.7.0/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 -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o array_slice.lo array_slice.cpp -/bin/bash ../libtool --tag=CXX 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-DPIC -o .libs/integrate2.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 -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c initialize.cpp -fPIC -DPIC -o .libs/initialize.o -boundaries.cpp: In member function 'meep::ivec meep::fields::ilattice_vector(meep::direction) const': -boundaries.cpp:68:5: warning: this statement may fall through [-Wimplicit-fallthrough=] - switch (d) { - ^~~~~~ -boundaries.cpp:73:3: note: here - case D3: - ^~~~ +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c cw_fields.cpp -fPIC -DPIC -o .libs/cw_fields.o dft.cpp: In function 'cdouble* meep::collapse_empty_dimensions(cdouble*, int*, int*, meep::volume)': dft.cpp:916:54: warning: 'void* memset(void*, int, size_t)' clearing an object of non-trivial type 'cdouble' {aka 'struct std::complex'}; use assignment or value-initialization instead [-Wclass-memaccess] memset(reduced_array,0,reduced_size*sizeof(cdouble)); @@ -1252,9 +1263,28 @@ dft.cpp:1030:34: warning: format '%lu' expects argument of type 'long unsigned int', but argument 4 has type 'size_t' {aka 'unsigned int'} [-Wformat=] if (!real_array) abort("%s:%i:out of memory(%lu)",__FILE__,__LINE__,array_size); ^~~~~~~~~~~~~~~~~~~~~~~~~~ ~~~~~~~~~~ +boundaries.cpp: In member function 'meep::ivec meep::fields::ilattice_vector(meep::direction) const': +boundaries.cpp:68:5: warning: this statement may fall through [-Wimplicit-fallthrough=] + switch (d) { + ^~~~~~ +boundaries.cpp:73:3: note: here + case D3: + ^~~~ libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 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-DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c susceptibility.cpp -fPIC -DPIC -o susceptibility.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 -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c mpb.cpp -fPIC -DPIC -o mpb.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 -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c structure.cpp -fPIC -DPIC -o structure.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 -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c vec.cpp -fPIC -DPIC -o vec.o >/dev/null 2>&1 libtool: compile: 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stress.lo structure.lo structure_dump.lo susceptibility.lo time.lo update_eh.lo mpb.lo update_pols.lo vec.lo step_generic.lo step_generic_stride1.lo -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c step_generic.cpp -fPIC -DPIC -o step_generic.o >/dev/null 2>&1 +/bin/sh ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 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-L/lib/../lib -L/usr/lib/i386-linux-gnu -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/8/../../.. -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/8/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/8/crtbeginS.o .libs/array_slice.o .libs/anisotropic_averaging.o .libs/bands.o .libs/boundaries.o .libs/bicgstab.o .libs/casimir.o .libs/control_c.o .libs/cw_fields.o .libs/dft.o .libs/dft_ldos.o .libs/energy_and_flux.o .libs/fields.o .libs/loop_in_chunks.o .libs/h5fields.o .libs/h5file.o .libs/initialize.o .libs/integrate.o .libs/integrate2.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/step_generic_stride1.o -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/8/crtendS.o /usr/lib/gcc/i686-linux-gnu/8/../../../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.12 -o .libs/libmeep.so.12.0.0 libtool: link: (cd ".libs" && rm -f "libmeep.so.12" && ln -s "libmeep.so.12.0.0" "libmeep.so.12") libtool: link: (cd ".libs" && rm -f "libmeep.so" && ln -s "libmeep.so.12.0.0" "libmeep.so") @@ -1550,15 +1584,15 @@ meep_wrap.cxx:29777:54: warning: type qualifiers ignored on cast result type [-Wignored-qualifiers] 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/meep-1.7.0=. -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-2.2 -lgc -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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 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meep-meep_wrap.o meep-main.o meep-geom.o meep-ctl-io.o ../src/.libs/libmeep.so -lctl -lguile-2.2 -lgc -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath make[4]: Leaving directory '/build/meep-1.7.0/scheme' make[3]: Leaving directory '/build/meep-1.7.0/scheme' Making all in libmeepgeom make[3]: Entering directory '/build/meep-1.7.0/libmeepgeom' i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -DDATADIR=\"./\" -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o bend-flux-ll.o bend-flux-ll.cpp -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -DDATADIR=\"./\" -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o meepgeom.lo meepgeom.cpp -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -DDATADIR=\"./\" -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 -DDATADIR=\"./\" -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o meepgeom.lo meepgeom.cpp +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -DDATADIR=\"./\" -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 -DDATADIR=\"./\" -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c GDSIIgeom.cpp -fPIC -DPIC -o .libs/GDSIIgeom.o libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -DDATADIR=\"./\" -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 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-ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libmeepgeom.la -rpath /usr/lib/i386-linux-gnu meepgeom.lo GDSIIgeom.lo ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libmeepgeom.la -rpath /usr/lib/i386-linux-gnu meepgeom.lo GDSIIgeom.lo ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/8/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/8/crtbeginS.o .libs/meepgeom.o .libs/GDSIIgeom.o -Wl,-rpath -Wl,/build/meep-1.7.0/src/.libs ../src/.libs/libmeep.so -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/8/crtendS.o /usr/lib/gcc/i686-linux-gnu/8/../../../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,libmeepgeom.so.12 -o .libs/libmeepgeom.so.12.0.0 libtool: link: (cd ".libs" && rm -f "libmeepgeom.so.12" && ln -s "libmeepgeom.so.12.0.0" "libmeepgeom.so.12") libtool: link: (cd ".libs" && rm -f "libmeepgeom.so" && ln -s "libmeepgeom.so.12.0.0" "libmeepgeom.so") @@ -1584,12 +1618,12 @@ i686-linux-gnu-ar: `u' modifier ignored since `D' is the default (see `U') libtool: link: i686-linux-gnu-ranlib .libs/libmeepgeom.a libtool: link: ( cd ".libs" && rm -f "libmeepgeom.la" && ln -s "../libmeepgeom.la" "libmeepgeom.la" ) -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 bend-flux-ll bend-flux-ll.o libmeepgeom.la -lctlgeom ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -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 bend-flux-ll bend-flux-ll.o libmeepgeom.la -lctlgeom ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/bend-flux-ll bend-flux-ll.o ./.libs/libmeepgeom.so -lctlgeom ../src/.libs/libmeep.so -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath make[3]: Leaving directory '/build/meep-1.7.0/libmeepgeom' Making all in libpympb make[3]: Entering directory '/build/meep-1.7.0/libpympb' -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -Wfatal-errors -I../libmeepgeom -I../src -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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../libmeepgeom -I../src -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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../libmeepgeom -I../src -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c pympb.cpp -fPIC -DPIC -o .libs/libpympb_la-pympb.o pympb.cpp: In member function 'int py_mpb::mode_solver::mean_epsilon(symmetric_matrix*, symmetric_matrix*, mpb_real*, mpb_real, mpb_real, mpb_real, mpb_real, const mpb_real*)': pympb.cpp:379:73: warning: 'mat2' may be used uninitialized in this function [-Wmaybe-uninitialized] @@ -1599,7 +1633,7 @@ else if (!(id1 < id2 && (id1 == id || meep_geom::material_type_equal(mat1, mat))) && ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~^~~~~~~~~~~ libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -Wfatal-errors -I../libmeepgeom -I../src -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 12:0:0 -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 -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 12:0:0 -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 -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/8/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/8/crtbeginS.o .libs/libpympb_la-pympb.o -Wl,-rpath -Wl,/build/meep-1.7.0/src/.libs ../src/.libs/libmeep.so -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/8/crtendS.o /usr/lib/gcc/i686-linux-gnu/8/../../../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.12 -o .libs/libpympb.so.12.0.0 libtool: link: (cd ".libs" && rm -f "libpympb.so.12" && ln -s "libpympb.so.12.0.0" "libpympb.so.12") libtool: link: (cd ".libs" && rm -f "libpympb.so" && ln -s "libpympb.so.12.0.0" "libpympb.so") @@ -1612,7 +1646,7 @@ make[3]: Entering directory '/build/meep-1.7.0/python' swig -Wextra -I../src -I../libmeepgeom -I../libpympb -I.. -outdir . -c++ -python -o meep-python.cpp ./meep.i swig -Wextra -I../src -I../libmeepgeom -I../libpympb -I.. -I../libpympb -outdir . -c++ -python -o mpb-python.cpp ./mpb.i -/bin/bash: git: command not found +/bin/sh: git: command not found cp meep.py __init__.py echo "__version__ = ''" >> __init__.py if [[ "3.0.12" = 3.0.12 ]]; then \ @@ -1625,10 +1659,12 @@ fi make all-am make[4]: Entering directory '/build/meep-1.7.0/python' -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python2.7 -I/usr/lib/python2.7/dist-packages/numpy/core/include -I../src -I../libmeepgeom -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o _meep_la-meep-python.lo `test -f 'meep-python.cpp' || echo './'`meep-python.cpp -/bin/bash ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python2.7 -I/usr/lib/python2.7/dist-packages/numpy/core/include -I../src -I../libmeepgeom -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o _mpb_la-mpb-python.lo `test -f 'mpb-python.cpp' || echo './'`mpb-python.cpp -/bin/bash: git: command not found +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python2.7 -I/usr/lib/python2.7/dist-packages/numpy/core/include -I../src -I../libmeepgeom -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o _meep_la-meep-python.lo `test -f 'meep-python.cpp' || echo './'`meep-python.cpp +/bin/sh ../libtool --tag=CXX --mode=compile i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python2.7 -I/usr/lib/python2.7/dist-packages/numpy/core/include -I../src -I../libmeepgeom -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o _mpb_la-mpb-python.lo `test -f 'mpb-python.cpp' || echo './'`mpb-python.cpp +/bin/sh: git: command not found cp meep.py __init__.py +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python2.7 -I/usr/lib/python2.7/dist-packages/numpy/core/include -I../src -I../libmeepgeom -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c mpb-python.cpp -fPIC -DPIC -o .libs/_mpb_la-mpb-python.o +libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python2.7 -I/usr/lib/python2.7/dist-packages/numpy/core/include -I../src -I../libmeepgeom -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c meep-python.cpp -fPIC -DPIC -o .libs/_meep_la-meep-python.o echo "__version__ = ''" >> __init__.py if [[ "3.0.12" = 3.0.12 ]]; then \ sed -i.bak '/^if _swig_python_version_info >= (2, 7, 0):/,/^else:/d' __init__.py; \ @@ -1638,8 +1674,6 @@ sed -i.bak '/^if _swig_python_version_info >= (2, 7, 0):/,/^else:/d' mpb.py; \ sed -i.bak 's/ import _mpb/from . import _mpb/' mpb.py; \ fi -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python2.7 -I/usr/lib/python2.7/dist-packages/numpy/core/include -I../src -I../libmeepgeom -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c meep-python.cpp -fPIC -DPIC -o .libs/_meep_la-meep-python.o -libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python2.7 -I/usr/lib/python2.7/dist-packages/numpy/core/include -I../src -I../libmeepgeom -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c mpb-python.cpp -fPIC -DPIC -o .libs/_mpb_la-mpb-python.o meep-python.cpp: In function 'PyObject* _wrap_abort__varargs__(PyObject*, PyObject*, PyObject*)': meep-python.cpp:18169:103: warning: unused parameter 'varargs' [-Wunused-parameter] SWIGINTERN PyObject *_wrap_abort__varargs__(PyObject *SWIGUNUSEDPARM(self), PyObject *args, PyObject *varargs) { @@ -1657,7 +1691,7 @@ SWIGINTERN PyObject *_wrap_master_fprintf__varargs__(PyObject *SWIGUNUSEDPARM(self), PyObject *args, PyObject *varargs) { ~~~~~~~~~~^~~~~~~ libtool: compile: i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I/usr/include/python2.7 -I/usr/lib/python2.7/dist-packages/numpy/core/include -I../src -I../libmeepgeom -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c mpb-python.cpp -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/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _mpb.la -rpath /usr/lib/python2.7/dist-packages/meep/mpb _mpb_la-mpb-python.lo ../libmeepgeom/libmeepgeom.la ../libpympb/libpympb.la -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _mpb.la -rpath /usr/lib/python2.7/dist-packages/meep/mpb _mpb_la-mpb-python.lo ../libmeepgeom/libmeepgeom.la ../libpympb/libpympb.la -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/8/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/8/crtbeginS.o .libs/_mpb_la-mpb-python.o -Wl,-rpath -Wl,/build/meep-1.7.0/libmeepgeom/.libs -Wl,-rpath -Wl,/build/meep-1.7.0/libpympb/.libs ../libmeepgeom/.libs/libmeepgeom.so ../libpympb/.libs/libpympb.so -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/8/crtendS.o /usr/lib/gcc/i686-linux-gnu/8/../../../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.12 -o .libs/_mpb.so.12.0.0 libtool: link: (cd ".libs" && rm -f "_mpb.so.12" && ln -s "_mpb.so.12.0.0" "_mpb.so.12") libtool: link: (cd ".libs" && rm -f "_mpb.so" && ln -s "_mpb.so.12.0.0" "_mpb.so") @@ -1666,7 +1700,7 @@ 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/python2.7 -I/usr/lib/python2.7/dist-packages/numpy/core/include -I../src -I../libmeepgeom -I../libpympb -I.. -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c meep-python.cpp -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/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _meep.la -rpath /usr/lib/python2.7/dist-packages/meep _meep_la-meep-python.lo ../src/libmeep.la ../libmeepgeom/libmeepgeom.la -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _meep.la -rpath /usr/lib/python2.7/dist-packages/meep _meep_la-meep-python.lo ../src/libmeep.la ../libmeepgeom/libmeepgeom.la -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/8/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/8/crtbeginS.o .libs/_meep_la-meep-python.o -Wl,-rpath -Wl,/build/meep-1.7.0/src/.libs -Wl,-rpath -Wl,/build/meep-1.7.0/libmeepgeom/.libs ../src/.libs/libmeep.so ../libmeepgeom/.libs/libmeepgeom.so -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/8/crtendS.o /usr/lib/gcc/i686-linux-gnu/8/../../../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.12 -o .libs/_meep.so.12.0.0 libtool: link: (cd ".libs" && rm -f "_meep.so.12" && ln -s "_meep.so.12.0.0" "_meep.so.12") libtool: link: (cd ".libs" && rm -f "_meep.so" && ln -s "_meep.so.12.0.0" "_meep.so") @@ -1691,727 +1725,727 @@ make[1]: Entering directory '/build/meep-1.7.0' find . -./meep-pkgconfig -./codemeta.json -./.travis.yml -./stamp-h1 -./AUTHORS -./meep.pc -./libtool -./autom4te.cache -./autom4te.cache/output.0 -./autom4te.cache/traces.0 -./autom4te.cache/traces.2 -./autom4te.cache/requests -./autom4te.cache/traces.1 -./autom4te.cache/output.1 -./autom4te.cache/output.2 +./missing +./.mailmap +./COPYRIGHT +./mkdocs.yml +./config.guess ./depcomp -./ltmain.sh -./libmeepgeom -./libmeepgeom/gdsII-3d.gds -./libmeepgeom/cyl-ellipsoid.ctl -./libmeepgeom/ring-ll.cpp -./libmeepgeom/pw-source-ll.cpp -./libmeepgeom/material_data.hpp -./libmeepgeom/absorber-1d-ll.cpp -./libmeepgeom/bend-flux-ll.cpp -./libmeepgeom/gdsII-3d.cpp -./libmeepgeom/libmeepgeom.la -./libmeepgeom/GDSIIgeom.lo -./libmeepgeom/user-defined-material.cpp -./libmeepgeom/Makefile.am -./libmeepgeom/cyl-ellipsoid-eps-ref.h5 -./libmeepgeom/GDSIIgeom.o -./libmeepgeom/Makefile.in -./libmeepgeom/bend-flux-ll.o -./libmeepgeom/meepgeom.lo -./libmeepgeom/array-slice-ll.h5 -./libmeepgeom/bend-flux-ll -./libmeepgeom/array-slice-ll.cpp -./libmeepgeom/cyl-ellipsoid-ll.cpp -./libmeepgeom/meepgeom.hpp -./libmeepgeom/meepgeom.o -./libmeepgeom/meepgeom.cpp -./libmeepgeom/Makefile -./libmeepgeom/dft-fields.cpp -./libmeepgeom/GDSIIgeom.cpp -./libmeepgeom/.libs -./libmeepgeom/.libs/libmeepgeom.la -./libmeepgeom/.libs/libmeepgeom.a -./libmeepgeom/.libs/GDSIIgeom.o -./libmeepgeom/.libs/bend-flux-ll -./libmeepgeom/.libs/libmeepgeom.lai -./libmeepgeom/.libs/libmeepgeom.so.12 -./libmeepgeom/.libs/meepgeom.o -./libmeepgeom/.libs/libmeepgeom.so -./libmeepgeom/.libs/libmeepgeom.so.12.0.0 -./.gitignore +./configure ./python -./python/geom.py -./python/mpb.i -./python/mpb-python.cpp -./python/__init__.py.bak -./python/solver.py -./python/simulation.py +./python/meep-python.cpp ./python/vec.i -./python/Makefile.am -./python/source.py -./python/_meep.la -./python/mpb_data.py -./python/Makefile.in -./python/_mpb.la ./python/mpb.py.bak -./python/meep.i -./python/meep -./python/meep/geom.py -./python/meep/simulation.py -./python/meep/source.py -./python/meep/materials.py -./python/meep/__init__.py -./python/meep/_meep.so -./python/meep/mpb -./python/meep/mpb/solver.py -./python/meep/mpb/_mpb.so -./python/meep/mpb/mpb_data.py -./python/meep/mpb/__init__.py -./python/examples -./python/examples/mpb_line_defect.py -./python/examples/mpb_data_analysis.py -./python/examples/wvg-src.py -./python/examples/absorber-1d.py -./python/examples/mpb_tutorial.py -./python/examples/binary_grating.py -./python/examples/solve-cw.py -./python/examples/mpb_strip.py -./python/examples/ring.py -./python/examples/binary_grating_oblique.py -./python/examples/antenna-radiation.py -./python/examples/coupler.gds -./python/examples/pw-source.py -./python/examples/holey-wvg-cavity.py -./python/examples/mpb_honey_rods.py -./python/examples/mpb_tri_rods.py -./python/examples/multilevel-atom.py -./python/examples/ring-cyl.py -./python/examples/mpb_sq_rods.py -./python/examples/cavity_arrayslice.py -./python/examples/mpb_bragg.py -./python/examples/bend-flux.py -./python/examples/coupler.py -./python/examples/ring-mode-overlap.py -./python/examples/mode-decomposition.py -./python/examples/parallel-wvgs-mpb.py -./python/examples/refl-quartz.py -./python/examples/mpb_diamond.py -./python/examples/cyl-ellipsoid.py -./python/examples/mpb_hole_slab.py -./python/examples/parallel-wvgs-force.py -./python/examples/holey-wvg-bands.py -./python/examples/mpb_bragg_sine.py -./python/examples/material-dispersion.py -./python/examples/metal-cavity-ldos.py -./python/examples/refl-angular.py -./python/examples/mpb_tri_holes.py -./python/examples/3rd-harm-1d.py -./python/examples/cavity-farfield.py -./python/numpy.i +./python/geom.py +./python/Makefile.in ./python/meep.py -./python/_meep_la-meep-python.lo -./python/materials.py -./python/meep-python.cpp -./python/_mpb_la-mpb-python.o +./python/_meep.la ./python/tests -./python/tests/mode_coeffs.py -./python/tests/user_defined_material.py +./python/tests/ring_cyl.py ./python/tests/geom.py -./python/tests/field_functions.py -./python/tests/refl_angular.py -./python/tests/binary_grating.py -./python/tests/chunks.py +./python/tests/3rd_harm_1d.py ./python/tests/ring.py +./python/tests/field_functions.py +./python/tests/antenna_radiation.py +./python/tests/mpb.py ./python/tests/simulation.py -./python/tests/dft_fields.py -./python/tests/bend_flux.py -./python/tests/physical.py -./python/tests/wvg_src.py -./python/tests/3rd_harm_1d.py ./python/tests/data +./python/tests/data/tri-rods-e.k11.b08.z.tm-r-m3-n32.h5 ./python/tests/data/tutorial-flux.v.k11.b08.te.h5 -./python/tests/data/eps_input_file_test.h5 -./python/tests/data/bend-flux.gds -./python/tests/data/amp_func_file.h5 +./python/tests/data/tutorial-b.k16.b08.te.h5 +./python/tests/data/cavity_arrayslice_1d.npy +./python/tests/data/diamond-dpwr.k06.b05.h5 ./python/tests/data/bragg-h.k01.b08.y.tm.h5 -./python/tests/data/tri-rods-e.k11.b08.z.tm-r-m3-n32.h5 -./python/tests/data/tutorial-C.k16.b08.te.h5 -./python/tests/data/line-defect-e.k04.b12.z.tm.h5 -./python/tests/data/tri-rods-e.k11.b08.z.tm.h5 -./python/tests/data/converted-tri-rods-e.k11.b08.tm.h5 ./python/tests/data/tutorial-te-eigenvectors-3-3.h5 -./python/tests/data/tutorial-b.k16.b08.te.h5 -./python/tests/data/tutorial-e.k16.b08.z.tm.h5 -./python/tests/data/tutorial-te-eigenvectors-8-1.h5 -./python/tests/data/cavity_arrayslice_2d.npy -./python/tests/data/tutorial-d.k16.b02.te.h5 +./python/tests/data/tutorial-d.k01.b02.te.h5 +./python/tests/data/tri-rods-epsilon-r-m3-n32.h5 ./python/tests/data/tutorial-mu.h5 -./python/tests/data/tutorial-e.k16.b08.te.h5 ./python/tests/data/hole-slab-h.k01.b09.z.zeven.h5 ./python/tests/data/tutorial-tot.rpwr.k16.b08.te.h5 -./python/tests/data/tutorial-h.k16.b08.te.h5 -./python/tests/data/strip-flux.v.k01.b04.x.h5 -./python/tests/data/tutorial-d.k16.b08.te.h5 -./python/tests/data/tutorial-d.k01.b02.te.h5 +./python/tests/data/tri-rods-e.k11.b08.z.tm.h5 +./python/tests/data/line-defect-e.k04.b12.z.tm.h5 +./python/tests/data/tutorial-te-eigenvectors-8-1.h5 +./python/tests/data/tutorial-epsilon.h5 +./python/tests/data/tutorial-e.k16.b08.te.h5 +./python/tests/data/bend-flux.gds ./python/tests/data/subpixel_avg-epsilon.h5 -./python/tests/data/cavity_arrayslice_1d.npy +./python/tests/data/tutorial-d.k16.b02.te.h5 +./python/tests/data/cavity_arrayslice_2d.npy +./python/tests/data/tutorial-d.k16.b08.te.h5 +./python/tests/data/converted-tri-rods-e.k11.b08.tm.h5 +./python/tests/data/strip-flux.v.k01.b04.x.h5 +./python/tests/data/tutorial-C.k16.b08.te.h5 +./python/tests/data/eps_input_file_test.h5 +./python/tests/data/tutorial-e.k16.b08.z.tm.h5 ./python/tests/data/converted-diamond-dpwr.k06.b05.h5 +./python/tests/data/amp_func_file.h5 +./python/tests/data/tutorial-h.k16.b08.te.h5 ./python/tests/data/tutorial-te-eigenvectors.h5 -./python/tests/data/diamond-dpwr.k06.b05.h5 -./python/tests/data/tutorial-epsilon.h5 -./python/tests/data/tri-rods-epsilon-r-m3-n32.h5 -./python/tests/holey_wvg_cavity.py -./python/tests/utils.py -./python/tests/mode_decomposition.py -./python/tests/source.py -./python/tests/ring_cyl.py -./python/tests/cyl_ellipsoid.py -./python/tests/cavity_arrayslice.py -./python/tests/material_dispersion.py -./python/tests/absorber_1d.py ./python/tests/pw_source.py -./python/tests/mpb.py +./python/tests/user_defined_material.py +./python/tests/force.py +./python/tests/physical.py +./python/tests/mode_coeffs.py ./python/tests/fragment_stats.py ./python/tests/multilevel_atom.py -./python/tests/holey_wvg_bands.py -./python/tests/force.py +./python/tests/binary_grating.py +./python/tests/refl_angular.py +./python/tests/cavity_arrayslice.py +./python/tests/bend_flux.py +./python/tests/chunks.py +./python/tests/material_dispersion.py +./python/tests/dft_fields.py +./python/tests/absorber_1d.py ./python/tests/ldos.py -./python/tests/antenna_radiation.py +./python/tests/utils.py +./python/tests/holey_wvg_cavity.py +./python/tests/wvg_src.py +./python/tests/cyl_ellipsoid.py +./python/tests/source.py +./python/tests/holey_wvg_bands.py ./python/tests/kdom.py -./python/_meep_la-meep-python.o -./python/_mpb_la-mpb-python.lo +./python/tests/mode_decomposition.py +./python/examples +./python/examples/coupler.gds +./python/examples/wvg-src.py +./python/examples/material-dispersion.py +./python/examples/coupler.py +./python/examples/mpb_hole_slab.py +./python/examples/mode-decomposition.py +./python/examples/refl-angular.py +./python/examples/ring.py +./python/examples/holey-wvg-bands.py +./python/examples/3rd-harm-1d.py +./python/examples/cyl-ellipsoid.py +./python/examples/solve-cw.py +./python/examples/mpb_tutorial.py +./python/examples/antenna-radiation.py +./python/examples/mpb_sq_rods.py +./python/examples/ring-cyl.py +./python/examples/mpb_diamond.py +./python/examples/refl-quartz.py +./python/examples/pw-source.py +./python/examples/multilevel-atom.py +./python/examples/binary_grating.py +./python/examples/holey-wvg-cavity.py +./python/examples/binary_grating_oblique.py +./python/examples/mpb_tri_rods.py +./python/examples/parallel-wvgs-force.py +./python/examples/cavity_arrayslice.py +./python/examples/mpb_data_analysis.py +./python/examples/mpb_strip.py +./python/examples/mpb_line_defect.py +./python/examples/metal-cavity-ldos.py +./python/examples/mpb_honey_rods.py +./python/examples/absorber-1d.py +./python/examples/bend-flux.py +./python/examples/cavity-farfield.py +./python/examples/ring-mode-overlap.py +./python/examples/parallel-wvgs-mpb.py +./python/examples/mpb_tri_holes.py +./python/examples/mpb_bragg_sine.py +./python/examples/mpb_bragg.py +./python/materials.py +./python/Makefile.am ./python/mpb.py +./python/_mpb_la-mpb-python.o +./python/simulation.py +./python/_meep_la-meep-python.lo +./python/numpy.i +./python/mpb.i +./python/typemap_utils.cpp +./python/mpb-python.cpp +./python/_meep_la-meep-python.o +./python/__init__.py.bak ./python/__init__.py +./python/meep.i +./python/meep +./python/meep/geom.py +./python/meep/_meep.so +./python/meep/materials.py +./python/meep/simulation.py +./python/meep/__init__.py +./python/meep/source.py +./python/meep/mpb +./python/meep/mpb/__init__.py +./python/meep/mpb/_mpb.so +./python/meep/mpb/solver.py +./python/meep/mpb/mpb_data.py +./python/_mpb_la-mpb-python.lo +./python/solver.py ./python/Makefile 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-./libpympb/.libs -./libpympb/.libs/libpympb_la-pympb.o -./libpympb/.libs/libpympb.so -./libpympb/.libs/libpympb.la -./libpympb/.libs/libpympb.so.12 -./libpympb/.libs/libpympb.so.12.0.0 -./libpympb/.libs/libpympb.lai -./libpympb/.libs/libpympb.a -./scheme -./scheme/meep-ctl-swig.hpp -./scheme/meep_wrap.cxx.bak -./scheme/meep-ctl-io.o -./scheme/meep_renames.i -./scheme/meep.cpp -./scheme/meep-ctl-const.hpp -./scheme/materials.scm -./scheme/Makefile.am -./scheme/ctl-io.h -./scheme/casimir.scm -./scheme/structure.cpp -./scheme/meep-ctl.hpp -./scheme/ctl-io.cpp -./scheme/ctl-io.i -./scheme/meep_wrap.patch -./scheme/meep-geom.o -./scheme/Makefile.in -./scheme/meep_enum_renames.i -./scheme/meep-structure.o -./scheme/meep.i -./scheme/meep-meep_wrap.o -./scheme/meep -./scheme/examples -./scheme/examples/holey-wvg-bands.ctl -./scheme/examples/metal-cavity-ldos.ctl -./scheme/examples/pw-source.ctl -./scheme/examples/holey-wvg-cavity.ctl -./scheme/examples/multilevel-atom.ctl -./scheme/examples/solve-cw.ctl -./scheme/examples/parallel-wvgs-mpb.ctl -./scheme/examples/ring-cyl.ctl -./scheme/examples/refl-quartz.ctl -./scheme/examples/bend-flux.ctl -./scheme/examples/parallel-wvgs-force.ctl -./scheme/examples/cavity-farfield.ctl -./scheme/examples/material-dispersion.ctl -./scheme/examples/ring.ctl -./scheme/examples/mode-coeffs.ctl -./scheme/examples/wvg_src.ctl -./scheme/examples/3rd-harm-1d.ctl -./scheme/examples/refl-angular.ctl -./scheme/examples/antenna-radiation.ctl -./scheme/geom.cpp -./scheme/meep-enums.scm -./scheme/meep-meep.o -./scheme/meep-main.o -./scheme/meep_swig_bug_workaround.i -./scheme/meep_wrap.cxx -./scheme/meep.scm.in -./scheme/Makefile -./scheme/meep.scm -./scheme/meep_wrap.cxx.orig -./scheme/meep_op_renames.i -./scheme/.libs -./scheme/.libs/meep -./scheme/main.cpp -./aclocal.m4 -./test-driver -./config.log -./configure.ac -./NEWS.md -./.pc -./.pc/.quilt_patches -./.pc/.version -./.pc/libgeom-fix-include.patch -./.pc/libgeom-fix-include.patch/libpympb -./.pc/libgeom-fix-include.patch/libpympb/pympb.cpp -./.pc/c++14.patch -./.pc/c++14.patch/libmeepgeom -./.pc/c++14.patch/libmeepgeom/ring-ll.cpp -./.pc/.quilt_series -./.pc/applied-patches -./.pc/fix-test.patch -./.pc/fix-test.patch/python -./.pc/fix-test.patch/python/simulation.py -./py-compile -./TODO -./config.guess -./config.h ./src -./src/anisotropic_averaging.o -./src/mpb.o -./src/array_slice.o -./src/cw_fields.lo -./src/dft.cpp -./src/integrate.lo +./src/initialize.lo +./src/bicgstab.cpp ./src/dft_ldos.o -./src/vec.cpp -./src/step.lo -./src/step_generic.lo -./src/h5fields.lo ./src/near2far.cpp -./src/update_pols.o +./src/control_c.lo +./src/integrate.lo +./src/update_eh.cpp +./src/step.lo +./src/dft.cpp +./src/energy_and_flux.cpp +./src/cw_fields.lo +./src/step_generic_stride1.cpp ./src/structure_dump.lo +./src/step_generic_stride1.lo +./src/step_generic.o +./src/integrate2.o +./src/sources.cpp +./src/Makefile.in +./src/casimir.cpp +./src/step.cpp +./src/susceptibility.lo +./src/update_eh.lo +./src/output_directory.o ./src/array_slice.lo -./src/output_directory.lo -./src/fields.o -./src/sphere-quad.cpp -./src/stress.cpp -./src/initialize.lo +./src/h5file.lo +./src/monitor.o +./src/casimir.o +./src/update_pols.o +./src/mympi.cpp +./src/bicgstab.lo +./src/Makefile.am +./src/time.lo +./src/step_db.o +./src/update_eh.o +./src/bicgstab.o +./src/h5fields.lo ./src/anisotropic_averaging.cpp -./src/initialize.cpp +./src/boundaries.lo ./src/loop_in_chunks.cpp -./src/control_c.o -./src/h5file.cpp -./src/step_db.o -./src/mympi.lo -./src/control_c.cpp -./src/structure_dump.o -./src/step_db.lo -./src/h5file.o -./src/integrate.o -./src/multilevel-atom.o +./src/casimir.lo ./src/integrate2.cpp ./src/update_pols.lo -./src/meep_internals.hpp -./src/update_eh.lo +./src/mpb.o +./src/fields.lo +./src/time.o +./src/output_directory.cpp +./src/step_generic.cpp +./src/step_db.cpp +./src/dft.lo +./src/integrate.cpp +./src/monitor.lo +./src/time.cpp +./src/anisotropic_averaging.o +./src/structure_dump.o +./src/step_db.lo +./src/array_slice.o +./src/step_generic_stride1.o ./src/bicgstab.hpp -./src/loop_in_chunks.o -./src/bands.o +./src/random.o +./src/output_directory.lo +./src/bands.cpp +./src/initialize.cpp +./src/step_generic.lo ./src/random.cpp -./src/structure.lo ./src/boundaries.cpp -./src/random.lo -./src/multilevel-atom.lo -./src/multilevel-atom.cpp -./src/mpb.lo -./src/structure.o -./src/Makefile.am -./src/h5fields.o -./src/integrate2.o -./src/structure_dump.cpp -./src/bicgstab.cpp -./src/monitor.o +./src/h5fields.cpp ./src/structure.cpp -./src/mpb.cpp -./src/cw_fields.cpp -./src/stress.o -./src/array_slice.cpp -./src/stress.lo -./src/casimir.lo -./src/step.cpp -./src/energy_and_flux.o +./src/multilevel-atom.lo ./src/loop_in_chunks.lo -./src/random.o -./src/monitor.lo -./src/step_generic_stride1.lo -./src/step_generic.cpp -./src/sources.cpp -./src/energy_and_flux.lo -./src/susceptibility.cpp -./src/Makefile.in -./src/cw_fields.o -./src/time.cpp +./src/monitor.cpp +./src/integrate2.lo +./src/control_c.o +./src/control_c.cpp +./src/mympi.o +./src/structure.lo ./src/dft.o -./src/libmeep.la -./src/sources.lo -./src/output_directory.cpp -./src/output_directory.o -./src/sphere_quad -./src/susceptibility.o -./src/casimir.cpp -./src/casimir.o -./src/near2far.lo +./src/vec.cpp +./src/sphere-quad.h +./src/initialize.o +./src/cw_fields.cpp +./src/h5fields.o +./src/cw_fields.o +./src/loop_in_chunks.o +./src/meep.hpp +./src/dft_ldos.cpp +./src/structure.o ./src/meep ./src/meep/mympi.hpp ./src/meep/vec.hpp -./src/initialize.o ./src/boundaries.o -./src/mympi.cpp -./src/bands.cpp -./src/step_generic.o -./src/dft.lo -./src/control_c.lo -./src/integrate2.lo -./src/sphere-quad.h -./src/bands.lo -./src/susceptibility.lo -./src/step_generic_stride1.cpp -./src/update_eh.cpp -./src/update_eh.o -./src/time.o -./src/dft_ldos.lo -./src/meep.hpp +./src/mpb.cpp ./src/near2far.o -./src/integrate.cpp -./src/vec.lo -./src/monitor.cpp -./src/fields.lo +./src/sphere_quad +./src/near2far.lo +./src/mpb.lo +./src/stress.cpp ./src/sources.o -./src/Makefile -./src/step.o -./src/sphere-quad.o +./src/multilevel-atom.cpp +./src/h5file.o ./src/update_pols.cpp -./src/step_generic_stride1.o -./src/step_db.cpp -./src/mympi.o -./src/time.lo -./src/vec.o +./src/susceptibility.o +./src/fields.cpp +./src/dft_ldos.lo ./src/anisotropic_averaging.lo -./src/bicgstab.o -./src/h5fields.cpp -./src/boundaries.lo -./src/bicgstab.lo +./src/meep_internals.hpp +./src/array_slice.cpp +./src/libmeep.la +./src/bands.lo +./src/integrate.o +./src/multilevel-atom.o +./src/mympi.lo +./src/random.lo +./src/energy_and_flux.o +./src/step.o +./src/sphere-quad.cpp +./src/Makefile +./src/bands.o +./src/vec.o +./src/stress.lo +./src/vec.lo +./src/sphere-quad.o ./src/.libs -./src/.libs/anisotropic_averaging.o -./src/.libs/mpb.o -./src/.libs/array_slice.o -./src/.libs/libmeep.lai ./src/.libs/dft_ldos.o -./src/.libs/libmeep.so +./src/.libs/step_generic.o +./src/.libs/integrate2.o +./src/.libs/output_directory.o +./src/.libs/libmeep.a +./src/.libs/libmeep.so.12.0.0 +./src/.libs/monitor.o +./src/.libs/casimir.o ./src/.libs/update_pols.o -./src/.libs/fields.o -./src/.libs/control_c.o ./src/.libs/step_db.o +./src/.libs/update_eh.o +./src/.libs/bicgstab.o +./src/.libs/libmeep.lai +./src/.libs/mpb.o +./src/.libs/time.o +./src/.libs/anisotropic_averaging.o ./src/.libs/structure_dump.o -./src/.libs/h5file.o -./src/.libs/integrate.o -./src/.libs/multilevel-atom.o -./src/.libs/loop_in_chunks.o -./src/.libs/bands.o -./src/.libs/structure.o -./src/.libs/h5fields.o -./src/.libs/integrate2.o -./src/.libs/monitor.o -./src/.libs/stress.o -./src/.libs/energy_and_flux.o +./src/.libs/array_slice.o +./src/.libs/step_generic_stride1.o ./src/.libs/random.o -./src/.libs/cw_fields.o +./src/.libs/control_c.o +./src/.libs/mympi.o ./src/.libs/dft.o -./src/.libs/libmeep.la -./src/.libs/output_directory.o -./src/.libs/susceptibility.o -./src/.libs/casimir.o ./src/.libs/initialize.o +./src/.libs/h5fields.o +./src/.libs/cw_fields.o +./src/.libs/loop_in_chunks.o +./src/.libs/structure.o ./src/.libs/boundaries.o -./src/.libs/step_generic.o -./src/.libs/libmeep.a -./src/.libs/update_eh.o -./src/.libs/time.o ./src/.libs/near2far.o ./src/.libs/sources.o +./src/.libs/libmeep.so +./src/.libs/h5file.o +./src/.libs/susceptibility.o +./src/.libs/libmeep.la +./src/.libs/integrate.o +./src/.libs/multilevel-atom.o +./src/.libs/energy_and_flux.o ./src/.libs/step.o -./src/.libs/step_generic_stride1.o -./src/.libs/mympi.o -./src/.libs/libmeep.so.12 +./src/.libs/bands.o ./src/.libs/vec.o -./src/.libs/bicgstab.o -./src/.libs/libmeep.so.12.0.0 -./src/dft_ldos.cpp -./src/fields.cpp -./src/energy_and_flux.cpp -./src/h5file.lo -./index.md -./debian -./debian/control -./debian/python-meep.prerm -./debian/rules -./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/libmeep12.lintian-overrides -./debian/source -./debian/source/format -./debian/source/lintian-overrides -./debian/meep.manpages -./debian/python-meep.postinst -./debian/watch -./debian/libmeep12.install -./debian/python-meep.install -./debian/changelog -./debian/meep.docs -./debian/patches -./debian/patches/series -./debian/patches/libgeom-fix-include.patch -./debian/patches/c++14.patch -./debian/patches/meep-suffix.patch -./debian/patches/fix-test.patch -./debian/patches/spelling.patch -./debian/compat -./debian/libmeep-dev.install -./debian/meep.1 -./debian/meep.install -./debian/autoreconf.before -./debian/docs -./debian/autoreconf.after -./debian/copyright -./COPYRIGHT -./README.md -./compile -./tests -./tests/near2far.cpp -./tests/convergence_cyl_waveguide.cpp -./tests/pml.cpp -./tests/one_dimensional.cpp -./tests/bragg_transmission.cpp -./tests/2D_convergence.cpp -./tests/three_d.cpp -./tests/Makefile.am -./tests/cylindrical.cpp -./tests/two_dimensional.cpp -./tests/Makefile.in -./tests/physical.cpp -./tests/known_results.cpp -./tests/symmetry.cpp -./tests/bench.cpp -./tests/flux.cpp -./tests/h5test.cpp -./tests/stress_tensor.cpp -./tests/integrate.cpp -./tests/harmonics.cpp -./tests/Makefile -./tests/aniso_disp.cpp -./autogen.sh +./src/.libs/stress.o +./src/.libs/fields.o +./src/.libs/libmeep.so.12 +./src/h5file.cpp +./src/stress.o +./src/fields.o +./src/energy_and_flux.lo +./src/susceptibility.cpp +./src/structure_dump.cpp +./src/sources.lo +./LICENSE +./configure.ac ./Makefile -./config.sub -./.mailmap +./meep-pkgconfig ./config.status +./AUTHORS +./test-driver +./aclocal.m4 +./m4 +./m4/acx_blas.m4 +./m4/ltsugar.m4 +./m4/lt~obsolete.m4 +./m4/ax_gcc_archflag.m4 +./m4/acx_mpi.m4 +./m4/libtool.m4 +./m4/ax_check_compiler_flags.m4 +./m4/pkg.m4 +./m4/ax_gcc_x86_cpuid.m4 +./m4/ax_cxx_maxopt.m4 +./m4/ltoptions.m4 +./m4/acx_lapack.m4 +./m4/ax_compiler_vendor.m4 +./m4/ltversion.m4 echo i386 i386 #if [ "i386" = "armel" ] || \ @@ -2442,65 +2476,65 @@ make aniso_disp bench bragg_transmission convergence_cyl_waveguide cylindrical flux harmonics integrate known_results near2far one_dimensional physical stress_tensor symmetry three_d two_dimensional 2D_convergence h5test pml make[4]: Entering directory '/build/meep-1.7.0/tests' i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/meep-1.7.0=. -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 -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -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 -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/meep-1.7.0=. -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 -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -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 -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/meep-1.7.0=. -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 -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../lib 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-fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o two_dimensional.o two_dimensional.cpp -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 two_dimensional two_dimensional.o ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -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 two_dimensional two_dimensional.o ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/two_dimensional two_dimensional.o ../src/.libs/libmeep.so -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 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-L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -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 2D_convergence 2D_convergence.o ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/2D_convergence 2D_convergence.o ../src/.libs/libmeep.so -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o h5test.o h5test.cpp -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 h5test h5test.o ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -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 h5test h5test.o ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/h5test h5test.o ../src/.libs/libmeep.so -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o pml.o pml.cpp pml.cpp: In function 'int check_pmlcyl(double (*)(const meep::vec&))': pml.cpp:220:10: warning: variable 'prev_refl_const' set but not used [-Wunused-but-set-variable] double prev_refl_const = 0.0, refl_const = 0.0; ^~~~~~~~~~~~~~~ -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 pml pml.o ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -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 pml pml.o ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/pml pml.o ../src/.libs/libmeep.so -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath make[4]: Leaving directory '/build/meep-1.7.0/tests' make check-TESTS @@ -2551,28 +2585,28 @@ make pw-source-ll ring-ll cyl-ellipsoid-ll absorber-1d-ll array-slice-ll user-defined-material dft-fields gdsII-3d make[4]: Entering directory '/build/meep-1.7.0/libmeepgeom' i686-linux-gnu-g++ -DHAVE_CONFIG_H -I. -I.. -I../src -DDATADIR=\"./\" -Wdate-time -D_FORTIFY_SOURCE=2 -I/usr/include/hdf5/serial -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o pw-source-ll.o pw-source-ll.cpp -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 pw-source-ll pw-source-ll.o libmeepgeom.la -lctlgeom ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/i386-linux-gnu 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-L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/dft-fields dft-fields.o ./.libs/libmeepgeom.so -lctlgeom ../src/.libs/libmeep.so -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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 -pthread -I/usr/include/guile/2.2 -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -c -o gdsII-3d.o gdsII-3d.cpp -/bin/bash ../libtool --tag=CXX --mode=link i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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 gdsII-3d gdsII-3d.o libmeepgeom.la -lctlgeom ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -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/meep-1.7.0=. -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 gdsII-3d gdsII-3d.o libmeepgeom.la -lctlgeom ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath libtool: link: i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -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/gdsII-3d gdsII-3d.o ./.libs/libmeepgeom.so -lctlgeom ../src/.libs/libmeep.so -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath make[4]: Leaving directory '/build/meep-1.7.0/libmeepgeom' make check-TESTS @@ -2600,7 +2634,7 @@ make[3]: Leaving directory '/build/meep-1.7.0/libpympb' Making check in python make[3]: Entering directory '/build/meep-1.7.0/python' -/bin/bash: git: command not found +/bin/sh: git: command not found cp meep.py __init__.py echo "__version__ = ''" >> __init__.py if [[ "3.0.12" = 3.0.12 ]]; then \ @@ -2613,7 +2647,7 @@ fi make check-am make[4]: Entering directory '/build/meep-1.7.0/python' -/bin/bash: git: command not found +/bin/sh: git: command not found cp meep.py __init__.py echo "__version__ = ''" >> __init__.py if [[ "3.0.12" = 3.0.12 ]]; then \ @@ -2652,7 +2686,7 @@ PASS: tests/ldos.py PASS: tests/material_dispersion.py FAIL: tests/mpb.py -FAIL: tests/mode_coeffs.py +PASS: tests/mode_coeffs.py PASS: tests/mode_decomposition.py FAIL: tests/multilevel_atom.py PASS: tests/physical.py @@ -2668,10 +2702,10 @@ Testsuite summary for meep 1.7.0 ============================================================================ # TOTAL: 31 -# PASS: 26 +# PASS: 27 # SKIP: 0 # XFAIL: 0 -# FAIL: 5 +# FAIL: 4 # XPASS: 0 # ERROR: 0 ============================================================================ @@ -2693,10 +2727,10 @@ ======================================= # TOTAL: 31 -# PASS: 26 +# PASS: 27 # SKIP: 0 # XFAIL: 0 -# FAIL: 5 +# FAIL: 4 # XPASS: 0 # ERROR: 0 @@ -2749,88 +2783,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0030357837677 +elapsed time for initialization: 0.0594160556793 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... 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: 0.170454978943 +elapsed time for k point: 0.385170936584 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.240492105484 +elapsed time for k point: 0.627752065659 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.234498023987 +elapsed time for k point: 0.631731033325 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.256114006042 +elapsed time for k point: 0.666668891907 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.217702865601 +elapsed time for k point: 0.49166893959 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.195486068726 +elapsed time for k point: 0.789235115051 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.20308804512 +elapsed time for k point: 0.548978805542 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.197257995605 +elapsed time for k point: 0.606755971909 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.203386068344 +elapsed time for k point: 0.59180188179 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.224762916565 +elapsed time for k point: 0.548347949982 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.28777384758 +elapsed time for k point: 0.691353082657 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.234775066376 +elapsed time for k point: 0.518884181976 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.18158698082 +elapsed time for k point: 0.412779092789 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.219604969025 +elapsed time for k point: 0.511978149414 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.204627037048 +elapsed time for k point: 0.54762005806 solve_kpoint (0,0,0): Solving for bands 3 to 8... 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: 0.130620002747 +.elapsed time for k point: 0.320660829544 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.2213570228 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.230619158264 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.216967769545 at Vector3<0.5, 0.0, 0.0> to 0.318992476569 at Vector3<0.0, 0.0, 0.0> @@ -2839,9 +2873,9 @@ Band 6 range: 0.341964725508 at Vector3<0.5, 0.3, 0.0> to 0.391554684426 at Vector3<0.5, 0.1, 0.0> Band 7 range: 0.349538537661 at Vector3<0.5, 0.5, 0.0> to 0.407373600123 at Vector3<0.4, 0.0, 0.0> Band 8 range: 0.39613882331 at Vector3<0.1, 0.1, 0.0> to 0.477306572259 at Vector3<0.5, 0.5, 0.0> -total elapsed time for run: 3.40693998337 +total elapsed time for run: 8.95372509956 done -test_anisotropic_2d_gap: 3.41s +test_anisotropic_2d_gap: 8.96s test_bragg ======================== @@ -2871,18 +2905,18 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.0, 0.0> -elapsed time for initialization: 0.000381946563721 +elapsed time for initialization: 0.00837087631226 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... Finished solving for bands 1 to 8 after 14 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: 0.00341010093689 -total elapsed time for run: 0.00384402275085 +elapsed time for k point: 0.0111730098724 +total elapsed time for run: 0.0197260379791 done Fixing h-field (band 8) phase by 0.909549 + -0.415597i; max ampl. = 1.96664 .Outputting fields to test_bragg-h.k01.b08.y.tm.h5... -test_bragg: 0.01s +test_bragg: 0.11s test_bragg_sine ======================== @@ -2920,81 +2954,81 @@ 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: 0.00145292282104 +elapsed time for initialization: 0.0997240543365 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... -Finished solving for bands 2 to 8 after 36 iterations. +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: 0.00594997406006 +elapsed time for k point: 0.0269010066986 solve_kpoint (0.05,0,0): Solving for bands 1 to 8... Finished solving for bands 1 to 8 after 81 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: 0.014643907547 +elapsed time for k point: 0.0322589874268 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.00242686271667 +elapsed time for k point: 0.0045280456543 solve_kpoint (0.15,0,0): Solving for bands 1 to 8... 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: 0.0022439956665 +elapsed time for k point: 0.00413179397583 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.00206995010376 +elapsed time for k point: 0.00412201881409 solve_kpoint (0.25,0,0): Solving for bands 1 to 8... 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: 0.00231099128723 +elapsed time for k point: 0.0912888050079 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.0020170211792 +elapsed time for k point: 0.095930814743 solve_kpoint (0.35,0,0): Solving for bands 1 to 8... 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: 0.00222587585449 +elapsed time for k point: 0.0157930850983 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.00182223320007 +elapsed time for k point: 0.00742816925049 solve_kpoint (0.45,0,0): Solving for bands 1 to 8... 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: 0.0019690990448 +elapsed time for k point: 0.0124580860138 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.00204586982727 +.elapsed time for k point: 0.00342106819153 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.194774663668 at Vector3<0.5, 0.0, 0.0> Band 2 range: 0.306403026231 at Vector3<0.5, 0.0, 0.0> to 0.468774852587 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.546625750132 at Vector3<0.0, 0.0, 0.0> to 0.731650442654 at Vector3<0.5, 0.0, 0.0> Band 4 range: 0.784261590509 at Vector3<0.5, 0.0, 0.0> to 0.989348615544 at Vector3<0.0, 0.0, 0.0> Band 5 range: 1.02405486481 at Vector3<0.0, 0.0, 0.0> to 1.2440980042 at Vector3<0.5, 0.0, 0.0> Band 6 range: 1.26665668619 at Vector3<0.5, 0.0, 0.0> to 1.4970379697 at Vector3<0.0, 0.0, 0.0> -Band 7 range: 1.51158009947 at Vector3<0.0, 0.0, 0.0> to 1.74883590399 at Vector3<0.5, 0.0, 0.0> -Band 8 range: 1.75816832085 at Vector3<0.5, 0.0, 0.0> to 1.99990720071 at Vector3<0.0, 0.0, 0.0> +Band 7 range: 1.51158009946 at Vector3<0.0, 0.0, 0.0> to 1.74883590399 at Vector3<0.5, 0.0, 0.0> +Band 8 range: 1.75816832085 at Vector3<0.5, 0.0, 0.0> to 1.99990720072 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.194774663668) to band 2 (0.306403026231), 44.5464212843% Gap from band 2 (0.468774852587) to band 3 (0.546625750132), 15.3340262625% Gap from band 3 (0.731650442654) to band 4 (0.784261590509), 6.94118744416% Gap from band 4 (0.989348615544) to band 5 (1.02405486481), 3.44752054018% Gap from band 5 (1.2440980042) to band 6 (1.26665668619), 1.79696424101% -Gap from band 6 (1.4970379697) to band 7 (1.51158009947), 0.966698293635% +Gap from band 6 (1.4970379697) to band 7 (1.51158009946), 0.966698293634% Gap from band 7 (1.74883590399) to band 8 (1.75816832085), 0.532215889061% -total elapsed time for run: 0.0416469573975 +total elapsed time for run: 0.399544000626 done -test_bragg_sine: 0.04s +test_bragg_sine: 0.42s test_compute_field_energy ======================== @@ -3039,88 +3073,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00280594825745 +elapsed time for initialization: 0.100522994995 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... 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: 0.226004123688 +elapsed time for k point: 0.570833206177 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.652390003204 +elapsed time for k point: 1.53025698662 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.147072076797 +elapsed time for k point: 0.405293941498 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.134953022003 +elapsed time for k point: 0.307821989059 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.158515930176 +elapsed time for k point: 0.439921140671 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.242794036865 +elapsed time for k point: 0.583035945892 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.17876791954 +elapsed time for k point: 0.416793107986 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.150408029556 +elapsed time for k point: 0.355937004089 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.133793115616 +elapsed time for k point: 0.335756063461 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.127295017242 +elapsed time for k point: 0.359819889069 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.124120950699 +elapsed time for k point: 0.318502902985 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0992071628571 +elapsed time for k point: 0.249184846878 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.116739034653 +elapsed time for k point: 0.291923999786 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.155891180038 +elapsed time for k point: 0.36304807663 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.183973789215 +elapsed time for k point: 0.564629077911 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.394901990891 +elapsed time for k point: 0.8655128479 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -3132,10 +3166,10 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.23127889633 +total elapsed time for run: 8.06116104126 done D-energy-components:, 16, 8, 0.499991, 0.500009, 0 -.test_compute_field_energy: 3.23s +.test_compute_field_energy: 8.07s test_compute_group_velocity ======================== @@ -3180,88 +3214,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00274610519409 +elapsed time for initialization: 0.00501394271851 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... 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: 0.229674100876 +elapsed time for k point: 0.486817836761 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.655882835388 +elapsed time for k point: 1.5345788002 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.146758079529 +elapsed time for k point: 0.395887851715 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.134456157684 +elapsed time for k point: 0.347213983536 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.154925107956 +elapsed time for k point: 0.430480957031 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.236099004745 +elapsed time for k point: 0.606310129166 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.178544044495 +elapsed time for k point: 0.491361141205 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.151247024536 +elapsed time for k point: 0.360184907913 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.132247209549 +elapsed time for k point: 0.298103094101 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.128843784332 +elapsed time for k point: 0.289149999619 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.125808954239 +elapsed time for k point: 0.308072090149 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.102197170258 +elapsed time for k point: 0.280194044113 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.115597963333 +elapsed time for k point: 0.307474851608 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.155430078506 +elapsed time for k point: 0.37578701973 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.184521913528 +elapsed time for k point: 0.438228845596 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.395133018494 +.elapsed time for k point: 0.880437135696 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -3273,9 +3307,9 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.23186302185 +total elapsed time for run: 7.83783507347 done -test_compute_group_velocity: 3.23s +test_compute_group_velocity: 7.84s test_compute_integrals ======================== @@ -3320,88 +3354,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00281715393066 +elapsed time for initialization: 0.00458383560181 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... 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: 0.228328943253 +elapsed time for k point: 0.483127832413 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.647897958755 +elapsed time for k point: 1.45217895508 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.14216709137 +elapsed time for k point: 0.340637922287 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.130851984024 +elapsed time for k point: 0.316601037979 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.157011985779 +elapsed time for k point: 0.352736949921 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.237453222275 +elapsed time for k point: 0.633483171463 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.180259943008 +elapsed time for k point: 0.451997995377 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.151934862137 +elapsed time for k point: 0.427695035934 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.130249977112 +elapsed time for k point: 0.317296981812 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.124828100204 +elapsed time for k point: 0.286556959152 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.125458955765 +elapsed time for k point: 0.303863048553 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0986349582672 +elapsed time for k point: 0.336040019989 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.115180015564 +elapsed time for k point: 0.383631944656 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.157264947891 +elapsed time for k point: 0.45582485199 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.187113046646 +elapsed time for k point: 0.435867071152 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.403427124023 +elapsed time for k point: 0.967818975449 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -3413,12 +3447,12 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.22246599197 +total elapsed time for run: 7.95252299309 done Fixing h-field (band 8) phase by 1 + -2.6145e-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 -.test_compute_integrals: 3.23s +.test_compute_integrals: 8.04s test_diamond ======================== @@ -3480,38 +3514,38 @@ 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: 0.0546469688416 +elapsed time for initialization: 0.285665035248 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... 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: 0.698179006577 +elapsed time for k point: 1.61571097374 solve_kpoint (0,0.525,0.475): Solving for bands 1 to 5... 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: 0.441701889038 +elapsed time for k point: 1.21566700935 solve_kpoint (0,0.55,0.45): Solving for bands 1 to 5... 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: 0.393595933914 +elapsed time for k point: 0.927547216415 solve_kpoint (0,0.575,0.425): Solving for bands 1 to 5... 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: 0.381181001663 +elapsed time for k point: 0.872992992401 solve_kpoint (0,0.6,0.4): Solving for bands 1 to 5... 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: 0.373556852341 +elapsed time for k point: 0.926398992538 solve_kpoint (0,0.625,0.375): Solving for bands 1 to 5... 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: 0.60095500946 +elapsed time for k point: 1.46635103226 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 test_diamond-dpwr.k06.b01.h5... @@ -3536,136 +3570,137 @@ Solving for bands 1 to 5... 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: 0.583914995193 +elapsed time for k point: 1.37512397766 solve_kpoint (0,0.575,0.225): Solving for bands 1 to 5... 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: 1.28940391541 +elapsed time for k point: 2.82388091087 solve_kpoint (0,0.55,0.15): Solving for bands 1 to 5... 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: 0.370985984802 +elapsed time for k point: 0.835557937622 solve_kpoint (0,0.525,0.075): Solving for bands 1 to 5... 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: 0.357746124268 +elapsed time for k point: 0.792088031769 solve_kpoint (0,0.5,0): Solving for bands 1 to 5... 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: 0.33726811409 +elapsed time for k point: 0.727866172791 solve_kpoint (0,0.4,0): Solving for bands 1 to 5... 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: 0.312767982483 +elapsed time for k point: 0.739764928818 solve_kpoint (0,0.3,0): Solving for bands 1 to 5... 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: 0.318414211273 +elapsed time for k point: 0.752738952637 solve_kpoint (0,0.2,0): Solving for bands 1 to 5... 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: 0.382140159607 +elapsed time for k point: 0.911010026932 solve_kpoint (0,0.1,0): Solving for bands 1 to 5... 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: 0.51035618782 +elapsed time for k point: 1.11986994743 solve_kpoint (0,0,0): Solving for bands 3 to 5... 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: 0.237029075623 +elapsed time for k point: 0.587821006775 solve_kpoint (0,0.1,0.1): Solving for bands 1 to 5... 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: 0.37988781929 +elapsed time for k point: 0.903804063797 solve_kpoint (0,0.2,0.2): Solving for bands 1 to 5... 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: 0.42206287384 +elapsed time for k point: 0.939949989319 solve_kpoint (0,0.3,0.3): Solving for bands 1 to 5... + iteration 151: trace = 1.068654718247573 (0.00227063% change) Finished solving for bands 1 to 5 after 195 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: 2.52588391304 +elapsed time for k point: 5.21325016022 solve_kpoint (0,0.4,0.4): Solving for bands 1 to 5... 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: 1.46713018417 +elapsed time for k point: 2.92975997925 solve_kpoint (0,0.5,0.5): Solving for bands 1 to 5... 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: 0.501555919647 +elapsed time for k point: 1.009100914 solve_kpoint (0.05,0.55,0.5): Solving for bands 1 to 5... 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: 0.723430156708 +elapsed time for k point: 1.4992249012 solve_kpoint (0.1,0.6,0.5): Solving for bands 1 to 5... 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: 0.545316934586 +elapsed time for k point: 1.15579891205 solve_kpoint (0.15,0.65,0.5): Solving for bands 1 to 5... 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: 0.575253009796 +elapsed time for k point: 1.21578907967 solve_kpoint (0.2,0.7,0.5): Solving for bands 1 to 5... 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: 0.563015937805 +elapsed time for k point: 1.15175199509 solve_kpoint (0.25,0.75,0.5): Solving for bands 1 to 5... 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: 0.961069822311 +elapsed time for k point: 1.98789906502 solve_kpoint (0.275,0.75,0.475): Solving for bands 1 to 5... 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: 0.548072814941 +elapsed time for k point: 1.13417196274 solve_kpoint (0.3,0.75,0.45): Solving for bands 1 to 5... 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: 0.398182153702 +elapsed time for k point: 0.861430883408 solve_kpoint (0.325,0.75,0.425): Solving for bands 1 to 5... 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: 0.444906949997 +elapsed time for k point: 0.951812028885 solve_kpoint (0.35,0.75,0.4): Solving for bands 1 to 5... 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: 0.516299009323 +elapsed time for k point: 1.03856396675 solve_kpoint (0.375,0.75,0.375): Solving for bands 1 to 5... 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 -.elapsed time for k point: 0.713047027588 +.elapsed time for k point: 1.38707995415 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.39455107479 at Vector3<0.25, 0.75, 0.5> Band 2 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.396765798568 at Vector3<0.3, 0.75, 0.45> Band 3 range: 0.442370770928 at Vector3<0.0, 0.5, 0.0> to 0.595589954344 at Vector3<0.0, 0.0, 0.0> Band 4 range: 0.44355516364 at Vector3<0.0, 0.5, 0.0> to 0.595819124738 at Vector3<0.0, 0.0, 0.0> Band 5 range: 0.503013589827 at Vector3<0.0, 0.6, 0.4> to 0.595838687299 at Vector3<0.0, 0.0, 0.0> Gap from band 2 (0.396765798568) to band 3 (0.442370770928), 10.8694994397% -total elapsed time for run: 18.9494299889 +total elapsed time for run: 41.4073131084 done -test_diamond: 18.98s +test_diamond: 41.55s test_epsilon_input_file ======================== @@ -3709,88 +3744,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00335597991943 +elapsed time for initialization: 0.176738977432 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... 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: 0.265012979507 +elapsed time for k point: 0.638314962387 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.124016046524 +elapsed time for k point: 0.379831790924 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.104121923447 +elapsed time for k point: 0.33580994606 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.116159915924 +elapsed time for k point: 0.359835863113 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.130722045898 +elapsed time for k point: 0.39182806015 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.178297042847 +elapsed time for k point: 0.475842952728 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.13689494133 +elapsed time for k point: 0.399821996689 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.120350122452 +elapsed time for k point: 0.363834142685 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.0936329364777 +elapsed time for k point: 0.287873983383 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.0891950130463 +elapsed time for k point: 0.207774877548 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.0884058475494 +elapsed time for k point: 0.20395898819 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0882329940796 +elapsed time for k point: 0.28379201889 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.10998415947 +elapsed time for k point: 0.343831062317 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.136021137238 +elapsed time for k point: 0.403659105301 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.146379947662 +elapsed time for k point: 0.420015096664 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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 -..elapsed time for k point: 0.156450033188 +..elapsed time for k point: 0.423753023148 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.497097784377 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.440289641051 at Vector3<0.5, 0.0, 0.0> to 0.578181285681 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.578181508201 at Vector3<0.5, 0.5, 0.0> to 0.761332777526 at Vector3<0.0, 0.0, 0.0> @@ -3802,13 +3837,13 @@ Gap from band 2 (0.578181285681) to band 3 (0.578181508201), 3.84861037669e-05% Gap from band 4 (0.80519998397) to band 5 (0.817084745355), 1.46518809801% Gap from band 7 (1.05803098325) to band 8 (1.06602335979), 0.752558574758% -total elapsed time for run: 2.08881020546 +total elapsed time for run: 6.0996029377 done -test_epsilon_input_file: 2.09s +test_epsilon_input_file: 6.10s test_first_brillouin_zone ======================== -test_first_brillouin_zone: 0.21s +test_first_brillouin_zone: 0.43s test_fractional_lattice ======================== @@ -3853,88 +3888,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.000465154647827 +elapsed time for initialization: 0.127423048019 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... 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: 0.00278091430664 +elapsed time for k point: 0.115605115891 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.00188422203064 +elapsed time for k point: 0.108214855194 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.00034499168396 +elapsed time for k point: 0.00893211364746 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.000341892242432 +elapsed time for k point: 0.00120496749878 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.000519037246704 +elapsed time for k point: 0.00140690803528 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.000336170196533 +elapsed time for k point: 0.0011899471283 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.000789880752563 +elapsed time for k point: 0.00291895866394 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.000329971313477 +elapsed time for k point: 0.0395460128784 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.000319004058838 +elapsed time for k point: 0.1118080616 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.000488042831421 +elapsed time for k point: 0.00176811218262 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.000317096710205 +elapsed time for k point: 0.0900499820709 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.00031590461731 +elapsed time for k point: 0.0363519191742 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.000867128372192 +elapsed time for k point: 0.00349879264832 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.000872135162354 +elapsed time for k point: 0.0879018306732 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.000401973724365 +elapsed time for k point: 0.0959651470184 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.000313997268677 +.elapsed time for k point: 0.0878870487213 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 2.04124145232 at Vector3<0.5, 0.5, 0.0> Band 2 range: 1.44337567297 at Vector3<0.5, 0.0, 0.0> to 2.88675134595 at Vector3<0.0, 0.0, 0.0> Band 3 range: 2.04124145232 at Vector3<0.5, 0.5, 0.0> to 3.22748612184 at Vector3<0.5, 0.0, 0.0> @@ -3943,9 +3978,9 @@ Band 6 range: 3.22748612184 at Vector3<0.5, 0.0, 0.0> to 4.56435464588 at Vector3<0.5, 0.5, 0.0> Band 7 range: 3.69684550214 at Vector3<0.2, 0.0, 0.0> to 4.56435464588 at Vector3<0.5, 0.5, 0.0> Band 8 range: 4.08248290464 at Vector3<0.0, 0.0, 0.0> to 5.20416499867 at Vector3<0.5, 0.0, 0.0> -total elapsed time for run: 0.0122652053833 +total elapsed time for run: 0.923689126968 done -test_fractional_lattice: 0.01s +test_fractional_lattice: 0.93s test_get_bfield ======================== @@ -3990,88 +4025,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00293684005737 +elapsed time for initialization: 0.14885187149 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... 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: 0.222813844681 +elapsed time for k point: 0.565351009369 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.64988899231 +elapsed time for k point: 1.41977405548 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.144796133041 +elapsed time for k point: 0.395869016647 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.134792089462 +elapsed time for k point: 0.319814920425 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.154287815094 +elapsed time for k point: 0.326804876328 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.239600896835 +elapsed time for k point: 0.525038957596 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.18315911293 +elapsed time for k point: 0.471843957901 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.154465913773 +elapsed time for k point: 0.431845903397 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.129357099533 +elapsed time for k point: 0.387830972672 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.124134063721 +elapsed time for k point: 0.379843950272 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.124032020569 +elapsed time for k point: 0.379801988602 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.101282119751 +elapsed time for k point: 0.251855134964 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.117867946625 +elapsed time for k point: 0.343819856644 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.156304836273 +elapsed time for k point: 0.371844053268 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.18446803093 +elapsed time for k point: 0.447948932648 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.406254053116 +elapsed time for k point: 0.823790073395 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -4083,10 +4118,10 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.23206305504 +total elapsed time for run: 7.99448895454 done Fixing b-field (band 8) phase by 1 + -2.6145e-07i; max ampl. = 4.48388 -.test_get_bfield: 3.24s +.test_get_bfield: 8.00s test_get_dfield ======================== @@ -4131,88 +4166,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00264596939087 +elapsed time for initialization: 0.0385031700134 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... 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: 0.229473114014 +elapsed time for k point: 0.469421863556 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.661772966385 +elapsed time for k point: 1.3587269783 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.14102101326 +elapsed time for k point: 0.371783018112 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.130815029144 +elapsed time for k point: 0.293252944946 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.153135061264 +elapsed time for k point: 0.320572137833 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.234900951385 +elapsed time for k point: 0.581734895706 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.178135871887 +elapsed time for k point: 0.495838880539 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.152415037155 +elapsed time for k point: 0.431820869446 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.131248950958 +elapsed time for k point: 0.391854047775 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.12805891037 +elapsed time for k point: 0.379835128784 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.124716997147 +elapsed time for k point: 0.375848054886 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0995070934296 +elapsed time for k point: 0.275917053223 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.114521980286 +elapsed time for k point: 0.34376001358 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.15823507309 +elapsed time for k point: 0.443780183792 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.187936067581 +elapsed time for k point: 0.503839969635 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.397944927216 +elapsed time for k point: 0.835824012756 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -4224,10 +4259,10 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.22804784775 +total elapsed time for run: 7.91486692429 done Fixing d-field (band 8) phase by -2.6145e-07 + -1i; max ampl. = 8.66842 -.test_get_dfield: 3.23s +.test_get_dfield: 7.92s test_get_efield ======================== @@ -4272,88 +4307,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00289392471313 +elapsed time for initialization: 0.0412199497223 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... 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: 0.227386951447 +elapsed time for k point: 0.55751991272 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.658696174622 +elapsed time for k point: 1.39380311966 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.142353057861 +elapsed time for k point: 0.321910858154 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.1351749897 +elapsed time for k point: 0.335938930511 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.156538963318 +elapsed time for k point: 0.332987070084 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.240489959717 +elapsed time for k point: 0.498686790466 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.180578947067 +elapsed time for k point: 0.376650094986 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.153035879135 +elapsed time for k point: 0.411143064499 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.130434989929 +elapsed time for k point: 0.391813993454 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.127111911774 +elapsed time for k point: 0.307806015015 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.12491106987 +elapsed time for k point: 0.275485992432 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0997438430786 +elapsed time for k point: 0.212532043457 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.115936040878 +elapsed time for k point: 0.279742002487 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.156811952591 +elapsed time for k point: 0.42778801918 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.184009075165 +elapsed time for k point: 0.503823041916 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.400429010391 +elapsed time for k point: 0.899832963943 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -4365,10 +4400,10 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.2381401062 +total elapsed time for run: 7.57122707367 done Fixing e-field (band 8) phase by -2.6145e-07 + -1i; max ampl. = 1.10099 -.test_get_efield: 3.24s +.test_get_efield: 7.59s test_get_eigenvectors ======================== @@ -4413,13 +4448,13 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00273704528809 +elapsed time for initialization: 0.0764091014862 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... 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: 0.224292993546 +elapsed time for k point: 0.557973146439 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 @@ -4432,7 +4467,7 @@ Solving for bands 1 to 8... 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: 0.652532100677 +elapsed time for k point: 1.38835406303 Fixing h-field (band 1) phase by -1 + 2.5898e-07i; max ampl. = 1.02721 Fixing h-field (band 2) phase by -0.999999 + 0.00113281i; max ampl. = 5.09036 Fixing h-field (band 3) phase by -0.000421363 + 1i; max ampl. = 3.73536 @@ -4445,7 +4480,7 @@ Solving for bands 1 to 8... 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: 0.142511844635 +elapsed time for k point: 0.382073879242 Fixing h-field (band 1) phase by 1 + -4.11737e-12i; max ampl. = 1.11365 Fixing h-field (band 2) phase by -1 + 5.19465e-09i; max ampl. = 4.92243 Fixing h-field (band 3) phase by 1.1028e-09 + -1i; max ampl. = 2.65638 @@ -4458,7 +4493,7 @@ Solving for bands 1 to 8... 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: 0.13152384758 +elapsed time for k point: 0.391993999481 Fixing h-field (band 1) phase by 1 + 7.00283e-16i; max ampl. = 1.27437 Fixing h-field (band 2) phase by -1 + -1.01461e-13i; max ampl. = 4.45322 Fixing h-field (band 3) phase by 1 + 2.593e-13i; max ampl. = 2.62315 @@ -4471,7 +4506,7 @@ Solving for bands 1 to 8... 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: 0.152636051178 +elapsed time for k point: 0.345852136612 Fixing h-field (band 1) phase by 1 + 6.05731e-18i; max ampl. = 1.5052 Fixing h-field (band 2) phase by 1 + -3.68414e-14i; max ampl. = 3.59052 Fixing h-field (band 3) phase by 1 + 1.236e-15i; max ampl. = 3.69829 @@ -4484,7 +4519,7 @@ Solving for bands 1 to 8... 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: 0.238194942474 +elapsed time for k point: 0.584600925446 Fixing h-field (band 1) phase by -1 + 1.05369e-15i; max ampl. = 1.38878 Fixing h-field (band 2) phase by 1 + 4.06147e-16i; max ampl. = 3.48407 Fixing h-field (band 3) phase by -1 + -1.97549e-15i; max ampl. = 4.1103 @@ -4497,7 +4532,7 @@ Solving for bands 1 to 8... 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: 0.180574178696 +elapsed time for k point: 0.491983890533 Fixing h-field (band 1) phase by 1 + -4.18569e-16i; max ampl. = 1.39153 Fixing h-field (band 2) phase by -1 + -4.96199e-13i; max ampl. = 3.54504 Fixing h-field (band 3) phase by 1 + -4.39168e-13i; max ampl. = 3.95334 @@ -4510,7 +4545,7 @@ Solving for bands 1 to 8... 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: 0.155215978622 +elapsed time for k point: 0.431976079941 Fixing h-field (band 1) phase by 1 + 4.51367e-17i; max ampl. = 1.40192 Fixing h-field (band 2) phase by 1 + 1.37821e-13i; max ampl. = 3.73151 Fixing h-field (band 3) phase by -1 + 1.55163e-12i; max ampl. = 3.50756 @@ -4523,7 +4558,7 @@ Solving for bands 1 to 8... 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: 0.136002779007 +elapsed time for k point: 0.305775165558 Fixing h-field (band 1) phase by 1 + 2.25635e-14i; max ampl. = 4.05119 Fixing h-field (band 2) phase by 1 + 9.82048e-17i; max ampl. = 1.42991 Fixing h-field (band 3) phase by -1 + -2.53674e-12i; max ampl. = 2.78416 @@ -4536,7 +4571,7 @@ Solving for bands 1 to 8... 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: 0.129415988922 +elapsed time for k point: 0.348644971848 Fixing h-field (band 1) phase by 1 + -2.21909e-16i; max ampl. = 4.46619 Fixing h-field (band 2) phase by -1 + 9.35272e-12i; max ampl. = 1.51506 Fixing h-field (band 3) phase by 1 + -5.2338e-16i; max ampl. = 1.66014 @@ -4549,7 +4584,7 @@ Solving for bands 1 to 8... 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: 0.127432107925 +elapsed time for k point: 0.36474609375 Fixing h-field (band 1) phase by 1 + -7.1386e-16i; max ampl. = 4.70977 Fixing h-field (band 2) phase by 1 + -5.05356e-14i; max ampl. = 1.38038 Fixing h-field (band 3) phase by 5.20197e-14 + 1i; max ampl. = 1.85505 @@ -4562,7 +4597,7 @@ Solving for bands 1 to 8... 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: 0.102950811386 +elapsed time for k point: 0.312783002853 Fixing h-field (band 1) phase by -1 + -1.04974e-16i; max ampl. = 3.59873 Fixing h-field (band 2) phase by -1 + 4.30575e-18i; max ampl. = 3.10702 Fixing h-field (band 3) phase by -4.23458e-10 + -1i; max ampl. = 1.92561 @@ -4575,7 +4610,7 @@ Solving for bands 1 to 8... 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: 0.119188070297 +elapsed time for k point: 0.342024803162 Fixing h-field (band 1) phase by 1 + 3.47643e-18i; max ampl. = 1.81199 Fixing h-field (band 2) phase by -1 + 2.07777e-16i; max ampl. = 4.51433 Fixing h-field (band 3) phase by 1.51247e-10 + 1i; max ampl. = 2.16532 @@ -4588,41 +4623,41 @@ Solving for bands 1 to 8... 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: 0.16429901123 -Fixing h-field (band 1) phase by 1 + 1.30152e-16i; max ampl. = 1.2604 -Fixing h-field (band 2) phase by -1 + 1.23163e-15i; max ampl. = 4.86397 -Fixing h-field (band 3) phase by -2.98705e-10 + 1i; max ampl. = 2.6696 -Fixing h-field (band 4) phase by -5.49062e-14 + 1i; max ampl. = 3.93612 -Fixing h-field (band 5) phase by -6.95304e-11 + -1i; max ampl. = 4.6489 -Fixing h-field (band 6) phase by 1.67146e-14 + -1i; max ampl. = 2.84446 -Fixing h-field (band 7) phase by -1 + -5.51736e-15i; max ampl. = 3.74182 -Fixing h-field (band 8) phase by -1 + -6.38252e-11i; max ampl. = 4.03853 +elapsed time for k point: 0.451988935471 +Fixing h-field (band 1) phase by 1 + 5.47029e-17i; max ampl. = 1.2604 +Fixing h-field (band 2) phase by -1 + -5.9968e-16i; max ampl. = 4.86397 +Fixing h-field (band 3) phase by -3.09161e-10 + 1i; max ampl. = 2.6696 +Fixing h-field (band 4) phase by -6.62305e-14 + 1i; max ampl. = 3.93612 +Fixing h-field (band 5) phase by -1.02613e-10 + -1i; max ampl. = 4.6489 +Fixing h-field (band 6) phase by 1.3828e-14 + -1i; max ampl. = 2.84446 +Fixing h-field (band 7) phase by -1 + -8.64634e-15i; max ampl. = 3.74182 +Fixing h-field (band 8) phase by -1 + -1.2525e-10i; max ampl. = 4.03853 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.187868118286 -Fixing h-field (band 1) phase by 1 + 1.67371e-16i; max ampl. = 1.05606 -Fixing h-field (band 2) phase by -1 + 9.33603e-15i; max ampl. = 5.06002 -Fixing h-field (band 3) phase by 1.49153e-12 + -1i; max ampl. = 3.59476 -Fixing h-field (band 4) phase by 6.72257e-15 + -1i; max ampl. = 4.14887 -Fixing h-field (band 5) phase by -1 + -2.25631e-09i; max ampl. = 1.36944 -Fixing h-field (band 6) phase by 2.22328e-13 + 1i; max ampl. = 3.24838 -Fixing h-field (band 7) phase by -1.01153e-10 + 1i; max ampl. = 2.57459 -Fixing h-field (band 8) phase by 1 + 7.04793e-15i; max ampl. = 4.85277 +elapsed time for k point: 0.490987062454 +Fixing h-field (band 1) phase by 1 + 2.76867e-16i; max ampl. = 1.05606 +Fixing h-field (band 2) phase by -1 + 4.76647e-15i; max ampl. = 5.06002 +Fixing h-field (band 3) phase by 5.48323e-12 + -1i; max ampl. = 3.59476 +Fixing h-field (band 4) phase by 8.94302e-15 + 1i; max ampl. = 4.14887 +Fixing h-field (band 5) phase by -1 + 4.11246e-10i; max ampl. = 1.36944 +Fixing h-field (band 6) phase by -5.12762e-13 + -1i; max ampl. = 3.24838 +Fixing h-field (band 7) phase by 1.45934e-10 + -1i; max ampl. = 2.57459 +Fixing h-field (band 8) phase by -1 + -1.07992e-14i; max ampl. = 4.85277 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.399594068527 +elapsed time for k point: 0.912075042725 Fixing h-field (band 1) phase by 1 + -0i; max ampl. = 1 -Fixing h-field (band 2) phase by 1 + 2.58618e-15i; max ampl. = 5.12967 -Fixing h-field (band 3) phase by -4.73016e-13 + -1i; max ampl. = 4.27896 -Fixing h-field (band 4) phase by -5.60099e-11 + -1i; max ampl. = 4.27882 -Fixing h-field (band 5) phase by 1 + -3.1985e-09i; max ampl. = 1.75894 -Fixing h-field (band 6) phase by -3.95611e-11 + 1i; max ampl. = 3.7555 -Fixing h-field (band 7) phase by 5.4375e-11 + -1i; max ampl. = 3.75555 -Fixing h-field (band 8) phase by -1 + -2.28345e-14i; max ampl. = 4.48388 +Fixing h-field (band 2) phase by 1 + -8.76644e-15i; max ampl. = 5.12967 +Fixing h-field (band 3) phase by -6.59989e-12 + 1i; max ampl. = 4.27896 +Fixing h-field (band 4) phase by -1.11395e-09 + 1i; max ampl. = 4.27882 +Fixing h-field (band 5) phase by 1 + -4.18384e-09i; max ampl. = 1.75894 +Fixing h-field (band 6) phase by 5.03018e-11 + 1i; max ampl. = 3.7555 +Fixing h-field (band 7) phase by -5.34957e-11 + -1i; max ampl. = 3.75555 +Fixing h-field (band 8) phase by -1 + 2.57704e-14i; max ampl. = 4.48388 .Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -4634,9 +4669,9 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097767% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.26424908638 +total elapsed time for run: 8.85883522034 done -test_get_eigenvectors: 3.28s +test_get_eigenvectors: 8.90s test_get_hfield ======================== @@ -4681,88 +4716,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0028338432312 +elapsed time for initialization: 0.164937019348 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... 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: 0.225339174271 +elapsed time for k point: 0.472058057785 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.659720182419 +elapsed time for k point: 1.4418759346 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.145048141479 +elapsed time for k point: 0.415848016739 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.133038043976 +elapsed time for k point: 0.387794971466 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.155698060989 +elapsed time for k point: 0.431843042374 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.241906881332 +elapsed time for k point: 0.563887119293 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.182445049286 +elapsed time for k point: 0.399745941162 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.157373905182 +elapsed time for k point: 0.360034942627 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.132483959198 +elapsed time for k point: 0.3636739254 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.128566026688 +elapsed time for k point: 0.304039955139 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.127232074738 +elapsed time for k point: 0.315708875656 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.101644992828 +elapsed time for k point: 0.224705219269 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.117830038071 +elapsed time for k point: 0.2445499897 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.161632061005 +elapsed time for k point: 0.418426990509 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.187949895859 +elapsed time for k point: 0.503620147705 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.400587081909 +elapsed time for k point: 0.919858932495 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -4774,10 +4809,10 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.26293206215 +total elapsed time for run: 7.93550395966 done Fixing h-field (band 8) phase by 1 + -2.6145e-07i; max ampl. = 4.48388 -.test_get_hfield: 3.27s +.test_get_hfield: 7.95s test_handle_cvector ======================== @@ -4822,63 +4857,63 @@ Vector3<-0.133333333333, 0.133333333333, 0.0> Vector3<-0.0666666666667, 0.0666666666667, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0031578540802 +elapsed time for initialization: 0.00794887542725 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... 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: 0.107153892517 +elapsed time for k point: 0.249472141266 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... 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: 0.10124206543 +elapsed time for k point: 0.247896194458 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... 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: 0.0835440158844 +elapsed time for k point: 0.27571105957 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... 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: 0.0789940357208 +elapsed time for k point: 0.247833013535 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... 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: 0.0735411643982 +elapsed time for k point: 0.18364405632 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... 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: 0.0737109184265 +elapsed time for k point: 0.183843135834 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... 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: 0.0683350563049 +elapsed time for k point: 0.23988699913 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... 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: 0.0678820610046 +elapsed time for k point: 0.251798868179 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... 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: 0.0577750205994 +elapsed time for k point: 0.239711046219 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... 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: 0.0572350025177 +elapsed time for k point: 0.227838993073 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... 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: 0.051971912384 +elapsed time for k point: 0.167784929276 Fixing e-field (band 1) phase by -1 + 4.11947e-08i; max ampl. = 0.93911 Fixing e-field (band 2) phase by 4.11947e-08 + 1i; max ampl. = 1.08316 Fixing e-field (band 3) phase by 1 + -4.11947e-08i; max ampl. = 0.877953 @@ -4891,27 +4926,27 @@ Solving for bands 1 to 8... 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: 0.0624969005585 +elapsed time for k point: 0.159741163254 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... 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: 0.0668768882751 +elapsed time for k point: 0.15310883522 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... 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: 0.0730428695679 +elapsed time for k point: 0.16099691391 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... 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: 0.094419002533 +elapsed time for k point: 0.233492851257 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.0711660385132 +.elapsed time for k point: 0.167884111404 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.274690225862 at Vector3<-0.333333333333, 0.333333333333, 0.0> Band 2 range: 0.445331080847 at Vector3<0.0, 0.5, 0.0> to 0.560518142316 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.490238914903 at Vector3<-0.333333333333, 0.333333333333, 0.0> to 0.56056079478 at Vector3<0.0, 0.0, 0.0> @@ -4925,7 +4960,7 @@ Gap from band 4 (0.790719597444) to band 5 (0.790832076333), 0.0142238651133% Gap from band 5 (0.837451116754) to band 6 (0.837594852844), 0.0171620472727% Gap from band 6 (0.86720092649) to band 7 (0.869134995574), 0.222775910928% -total elapsed time for run: 1.19679617882 +total elapsed time for run: 3.42189502716 done Read lattice vectors Read Bloch wavevector (-0.333333, 0.333333, 0) @@ -4943,7 +4978,7 @@ imag part range: -6.6866e-33 .. 6.6866e-33 real part range: -1.03932 .. 1.03493 imag part range: -1.08496 .. 1.08496 -test_handle_cvector: 1.24s +test_handle_cvector: 3.51s test_hermitian_eps ======================== @@ -4983,78 +5018,105 @@ Vector3<0.333333333333, 0.333333333333, 0.0> Vector3<0.166666666667, 0.166666666667, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.003338098526 +elapsed time for initialization: 0.177040100098 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... - iteration 454: trace = 2.40721311328217 (0.00084908% change) - iteration 911: trace = 2.393587460940838 (0.00013545% change) - iteration 1369: trace = 2.393039937413587 (8.54534e-08% change) + iteration 219: trace = 2.57580415141969 (0.0946378% change) + iteration 440: trace = 2.40793664287558 (0.00131813% change) + iteration 660: trace = 2.399349172554611 (0.00104012% change) + iteration 876: trace = 2.393725697410036 (0.000349888% change) + iteration 1094: trace = 2.393109181006932 (2.86454e-05% change) + iteration 1306: trace = 2.39304028491193 (2.6789e-07% change) + iteration 1520: trace = 2.393039457203807 (5.61658e-08% change) Finished solving for bands 2 to 10 after 1610 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: 14.1513810158 +elapsed time for k point: 29.8617680073 solve_kpoint (0.166667,0,0): Solving for bands 1 to 10... - iteration 395: trace = 2.412639522376697 (1.49214e-06% change) - iteration 791: trace = 2.41263024043096 (3.93641e-08% change) - iteration 1183: trace = 2.412629768701752 (7.33318e-09% change) + iteration 177: trace = 2.412688582987237 (2.93242e-05% change) + iteration 354: trace = 2.412642750734599 (6.50557e-07% change) + iteration 536: trace = 2.412633122823085 (3.92385e-07% change) + iteration 714: trace = 2.41263057066892 (2.2064e-07% change) + iteration 893: trace = 2.412629965952715 (7.7357e-08% change) + iteration 1072: trace = 2.412629803224768 (1.318e-08% change) + iteration 1251: trace = 2.412629759618535 (1.49904e-09% change) + iteration 1428: trace = 2.412629748755844 (3.83212e-10% change) Finished solving for bands 1 to 10 after 1488 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: 15.1254107952 +elapsed time for k point: 33.5357739925 solve_kpoint (0.333333,0,0): Solving for bands 1 to 10... - iteration 395: trace = 2.451861579593161 (7.77115e-06% change) - iteration 792: trace = 2.451791112565402 (7.35076e-07% change) - iteration 1182: trace = 2.451789445239164 (5.40392e-09% change) + iteration 189: trace = 2.452350224115282 (0.000273201% change) + iteration 379: trace = 2.451875745905228 (2.46092e-05% change) + iteration 568: trace = 2.45180242519032 (3.98201e-06% change) + iteration 755: trace = 2.451791578257001 (9.23845e-07% change) + iteration 941: trace = 2.451789800197658 (2.31675e-07% change) + iteration 1125: trace = 2.451789463430299 (1.06974e-08% change) + iteration 1314: trace = 2.451789426452183 (2.94481e-09% change) Finished solving for bands 1 to 10 after 1443 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: 14.7188899517 +elapsed time for k point: 30.9157559872 solve_kpoint (0.5,0,0): Solving for bands 1 to 10... - iteration 393: trace = 2.449310513147637 (1.10402e-05% change) - iteration 783: trace = 2.449292946998937 (5.6127e-08% change) - iteration 1165: trace = 2.449292759298291 (1.94259e-09% change) + iteration 191: trace = 2.449588297708942 (0.000174699% change) + iteration 379: trace = 2.449313051126506 (7.10853e-06% change) + iteration 567: trace = 2.44929596880284 (5.49021e-07% change) + iteration 756: trace = 2.449293148540933 (5.45166e-08% change) + iteration 946: trace = 2.449292782709 (1.17059e-08% change) + iteration 1135: trace = 2.449292760214355 (6.09829e-10% change) Finished solving for bands 1 to 10 after 1256 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: 12.945982933 +elapsed time for k point: 26.7648630142 solve_kpoint (0.5,0.166667,0): Solving for bands 1 to 10... - iteration 394: trace = 2.485874373242396 (5.78995e-06% change) - iteration 789: trace = 2.485865212896159 (1.43019e-08% change) + iteration 191: trace = 2.48607544641331 (0.000247219% change) + iteration 383: trace = 2.485876232809364 (7.68544e-06% change) + iteration 575: trace = 2.485865693905791 (4.58888e-07% change) + iteration 766: trace = 2.485865221889747 (1.44978e-08% change) + iteration 953: trace = 2.485865195913662 (5.02781e-10% change) Finished solving for bands 1 to 10 after 1033 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: 10.5171408653 +elapsed time for k point: 21.8161010742 solve_kpoint (0.5,0.333333,0): Solving for bands 1 to 10... - iteration 391: trace = 2.578882666117282 (1.19191e-06% change) + iteration 187: trace = 2.57904247070738 (0.000104559% change) + iteration 374: trace = 2.578883177451668 (1.68809e-06% change) + iteration 564: trace = 2.57888167139089 (7.02385e-09% change) Finished solving for bands 1 to 10 after 692 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: 7.11827015877 +elapsed time for k point: 14.8464329243 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 10... - iteration 393: trace = 2.65386096734471 (1.07186e-08% change) + iteration 192: trace = 2.653877309875673 (4.19335e-06% change) + iteration 384: trace = 2.653860971348764 (4.95968e-08% change) Finished solving for bands 1 to 10 after 489 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: 4.99400901794 +elapsed time for k point: 10.2838110924 solve_kpoint (0.333333,0.333333,0): Solving for bands 1 to 10... - iteration 393: trace = 2.53222673216921 (2.12768e-07% change) + iteration 192: trace = 2.532263429169417 (5.58782e-05% change) + iteration 384: trace = 2.532226759481988 (1.71551e-07% change) + iteration 571: trace = 2.532226605813633 (1.37475e-09% change) Finished solving for bands 1 to 10 after 649 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: 6.64682817459 +elapsed time for k point: 13.7357780933 solve_kpoint (0.166667,0.166667,0): Solving for bands 1 to 10... - iteration 391: trace = 2.429161307654619 (3.76214e-07% change) - iteration 783: trace = 2.429159856055172 (1.85151e-09% change) + iteration 192: trace = 2.429205483825089 (6.45201e-05% change) + iteration 385: trace = 2.429161487721509 (5.56473e-07% change) + iteration 577: trace = 2.429159929278623 (6.97637e-08% change) + iteration 768: trace = 2.429159857076395 (1.01646e-09% change) Finished solving for bands 1 to 10 after 866 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: 8.88018298149 +elapsed time for k point: 18.2077200413 solve_kpoint (0,0,0): Solving for bands 2 to 10... - iteration 457: trace = 2.393039445285402 (1.26866e-08% change) + iteration 227: trace = 2.393041510984133 (3.87881e-06% change) + iteration 455: trace = 2.393039445691114 (1.29701e-08% change) Finished solving for bands 2 to 10 after 637 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: 5.58572506905 +.elapsed time for k point: 11.2757601738 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.215648526308 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.265884978566 at Vector3<0.0, 0.0, 0.0> to 0.354630240547 at Vector3<0.333333333333, 0.333333333333, 0.0> Band 3 range: 0.356214235592 at Vector3<0.166666666667, 0.166666666667, 0.0> to 0.365278335178 at Vector3<0.5, 0.0, 0.0> @@ -5070,9 +5132,9 @@ Gap from band 3 (0.365278335178) to band 4 (0.368990136667), 1.01102025516% Gap from band 7 (0.607920081823) to band 8 (0.615051876483), 1.16630550873% Gap from band 8 (0.635680784654) to band 9 (0.639709760932), 0.631802751339% -total elapsed time for run: 100.688442945 +total elapsed time for run: 211.423281908 done -test_hermitian_eps: 100.69s +test_hermitian_eps: 211.43s test_hole_slab ======================== @@ -5108,24 +5170,28 @@ Initializing fields to random numbers... 1 k-points Vector3<-0.333333333333, 0.333333333333, 0.0> -elapsed time for initialization: 0.212602138519 +elapsed time for initialization: 0.397584915161 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... + iteration 4: trace = 2.402412493859785 (10.5287% change) iteration 8: trace = 2.197424295814806 (0.438829% change) - iteration 17: trace = 2.187966030722349 (0.000399861% change) - iteration 25: trace = 2.187958069786946 (2.17494e-07% change) + iteration 12: trace = 2.188582973205607 (0.0338964% change) + iteration 16: trace = 2.187974779563379 (0.00115651% change) + iteration 20: trace = 2.18795888606421 (4.07356e-05% change) + iteration 24: trace = 2.187958074545613 (2.68951e-06% change) + iteration 28: trace = 2.187958069713362 (3.1166e-10% 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: 15.7936019897 -total elapsed time for run: 16.0063309669 +elapsed time for k point: 36.8867409229 +total elapsed time for run: 37.2844901085 done Fixing h-field (band 9) phase by -0.0246538 + -0.999696i; max ampl. = 2.37913 .Outputting fields to test_hole_slab-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 = 232048195.548 -mean time per iteration = 0.516333256998 s -test_hole_slab: 16.04s +mean time per iteration = 1.20272548737 s +test_hole_slab: 37.40s test_honey_rods ======================== @@ -5172,88 +5238,88 @@ Vector3<-0.133333333333, 0.133333333333, 0.0> Vector3<-0.0666666666667, 0.0666666666667, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00324392318726 +elapsed time for initialization: 0.00799798965454 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... 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: 0.164142131805 +elapsed time for k point: 0.445192098618 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... 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: 0.185262918472 +elapsed time for k point: 0.50380396843 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... 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: 0.0944249629974 +elapsed time for k point: 0.235906124115 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... 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: 0.087886095047 +elapsed time for k point: 0.259826898575 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... 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: 0.082827091217 +elapsed time for k point: 0.235840797424 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... 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: 0.0729219913483 +elapsed time for k point: 0.164371967316 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... 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: 0.0670499801636 +elapsed time for k point: 0.14189696312 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... 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: 0.0771889686584 +elapsed time for k point: 0.249231100082 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... 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: 0.0786068439484 +elapsed time for k point: 0.27584195137 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... 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: 0.0884008407593 +elapsed time for k point: 0.315831899643 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... 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: 0.151142120361 +elapsed time for k point: 0.358564138412 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... 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: 0.0826869010925 +elapsed time for k point: 0.261137008667 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... 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: 0.0731680393219 +elapsed time for k point: 0.215834856033 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... 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: 0.0727560520172 +elapsed time for k point: 0.167893886566 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... 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: 0.0906291007996 +elapsed time for k point: 0.279875993729 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.401317119598 +elapsed time for k point: 0.875048875809 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.335116766035 at Vector3<-0.333333333333, 0.333333333333, 0.0> Band 2 range: 0.335185075992 at Vector3<-0.333333333333, 0.333333333333, 0.0> to 0.429848112378 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.575170934543 at Vector3<-0.333333333333, 0.333333333333, 0.0> to 0.725589767226 at Vector3<0.0, 0.0, 0.0> @@ -5266,7 +5332,7 @@ Gap from band 2 (0.429848112378) to band 3 (0.575170934543), 28.9194165245% Gap from band 5 (0.779379221209) to band 6 (0.785278698442), 0.754091633513% Gap from band 7 (0.912256043901) to band 8 (1.05403505081), 14.4209580456% -total elapsed time for run: 1.87519192696 +total elapsed time for run: 4.99672484398 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -5311,88 +5377,88 @@ Vector3<-0.133333333333, 0.133333333333, 0.0> Vector3<-0.0666666666667, 0.0666666666667, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00333404541016 +elapsed time for initialization: 0.00599002838135 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... 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: 0.35679101944 +elapsed time for k point: 0.822392225266 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... 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: 0.252625226974 +elapsed time for k point: 0.647603988647 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... 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: 0.132407903671 +elapsed time for k point: 0.403897047043 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... 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: 0.131613969803 +elapsed time for k point: 0.307812929153 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... 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: 0.153548002243 +elapsed time for k point: 0.343842029572 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... 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: 0.192711830139 +elapsed time for k point: 0.435795068741 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... 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: 0.148360013962 +elapsed time for k point: 0.319506883621 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... 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: 0.163612127304 +elapsed time for k point: 0.353357076645 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... 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: 0.167783021927 +elapsed time for k point: 0.446751117706 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... 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: 0.175437927246 +elapsed time for k point: 0.404320001602 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... 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: 0.361615896225 +elapsed time for k point: 0.771259069443 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... 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: 0.507725954056 +elapsed time for k point: 1.0798740387 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... 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: 0.127159833908 +elapsed time for k point: 0.315845012665 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... 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: 0.123881816864 +elapsed time for k point: 0.363744020462 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... 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: 0.132243156433 +elapsed time for k point: 0.323902130127 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.261843919754 +.elapsed time for k point: 0.623759031296 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.553509348997 at Vector3<-0.333333333333, 0.333333333333, 0.0> Band 2 range: 0.520318359084 at Vector3<0.0, 0.5, 0.0> to 0.727844751545 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.576335859651 at Vector3<-0.333333333333, 0.333333333333, 0.0> to 0.788087893062 at Vector3<0.0, 0.0, 0.0> @@ -5404,9 +5470,9 @@ Gap from band 3 (0.788087893062) to band 4 (0.816173029367), 3.50131776109% Gap from band 5 (0.92208494259) to band 6 (1.01686566839), 9.77649716965% Gap from band 7 (1.15937022737) to band 8 (1.16367190504), 0.370348656678% -total elapsed time for run: 3.39435791969 +total elapsed time for run: 7.97277903557 done -test_honey_rods: 5.27s +test_honey_rods: 12.97s test_line_defect ======================== @@ -5455,16 +5521,17 @@ Vector3<0.3, 1.05, 0.0> Vector3<0.4, 1.4, 0.0> Vector3<0.5, 1.75, 0.0> -elapsed time for initialization: 0.0217800140381 +elapsed time for initialization: 0.225257158279 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... Finished solving for bands 2 to 7 after 16 iterations. Solving for bands 8 to 12... + iteration 58: trace = 1.211589507242226 (2.1982e-07% change) 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: 2.86253285408 +elapsed time for k point: 6.48226594925 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 @@ -5496,7 +5563,7 @@ 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: 1.55545783043 +elapsed time for k point: 3.65529298782 Fixing e-field (band 1) phase by -1 + 2.71695e-09i; max ampl. = 0.279221 Fixing e-field (band 2) phase by 0.0662341 + 0.997804i; max ampl. = 0.368961 Fixing e-field (band 3) phase by 1 + -3.08291e-07i; max ampl. = 0.357513 @@ -5528,7 +5595,7 @@ 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: 1.37069988251 +elapsed time for k point: 3.25436496735 Fixing e-field (band 1) phase by 1 + -6.81446e-16i; max ampl. = 0.316626 Fixing e-field (band 2) phase by -6.15786e-11 + -1i; max ampl. = 0.383063 Fixing e-field (band 3) phase by 1 + -1.01515e-14i; max ampl. = 0.3761 @@ -5557,10 +5624,11 @@ Solving for bands 1 to 6... Finished solving for bands 1 to 6 after 8 iterations. Solving for bands 7 to 12... + iteration 50: trace = 1.306672769618134 (8.50114e-07% change) 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: 3.50000691414 +elapsed time for k point: 8.23339009285 Fixing e-field (band 1) phase by 1 + -3.32623e-17i; max ampl. = 0.362092 Fixing e-field (band 2) phase by 8.10447e-12 + -1i; max ampl. = 0.407764 Fixing e-field (band 3) phase by -1 + -8.70243e-16i; max ampl. = 0.420136 @@ -5589,10 +5657,11 @@ Solving for bands 1 to 6... Finished solving for bands 1 to 6 after 9 iterations. Solving for bands 7 to 12... + iteration 50: trace = 1.269582088919498 (6.98992e-08% change) 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: 2.59605908394 +elapsed time for k point: 6.11546707153 Fixing e-field (band 1) phase by 1 + -3.62375e-17i; max ampl. = 0.407996 Fixing e-field (band 2) phase by 9.94377e-13 + -1i; max ampl. = 0.441101 Fixing e-field (band 3) phase by 1 + 1.09519e-15i; max ampl. = 0.464954 @@ -5624,7 +5693,7 @@ 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: 0.820185184479 +elapsed time for k point: 1.94044709206 Fixing e-field (band 1) phase by 1 + -1.18908e-16i; max ampl. = 0.422882 Fixing e-field (band 2) phase by 2.75053e-12 + -1i; max ampl. = 0.466091 Fixing e-field (band 3) phase by -1 + -1.4156e-16i; max ampl. = 0.462198 @@ -5663,9 +5732,9 @@ Band 12 range: 0.465690463972 at Vector3<0.5, 1.75, 0.0> to 0.545122984666 at Vector3<0.0, 0.0, 0.0> Gap from band 6 (0.270821263668) to band 7 (0.337337103113), 21.8745126527% Gap from band 7 (0.442497664917) to band 8 (0.448262776554), 1.2944247114% -total elapsed time for run: 13.0325729847 +total elapsed time for run: 33.3477680683 done -test_line_defect: 13.04s +test_line_defect: 33.42s test_list_split ======================== @@ -5714,88 +5783,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00288319587708 +elapsed time for initialization: 0.00748991966248 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... 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: 0.229955911636 +elapsed time for k point: 0.461560964584 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.66104388237 +elapsed time for k point: 1.36546897888 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.144381046295 +elapsed time for k point: 0.394193172455 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.134459972382 +elapsed time for k point: 0.391935825348 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.155514955521 +elapsed time for k point: 0.395829916 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.241905927658 +elapsed time for k point: 0.518476963043 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.182453155518 +elapsed time for k point: 0.433135986328 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.155734062195 +elapsed time for k point: 0.375928878784 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.135323047638 +elapsed time for k point: 0.289499998093 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.128214120865 +elapsed time for k point: 0.26540184021 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.127787828445 +elapsed time for k point: 0.276607990265 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.102506875992 +elapsed time for k point: 0.247792005539 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.119429826736 +elapsed time for k point: 0.359832048416 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.162221908569 +elapsed time for k point: 0.439904928207 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.190176010132 +elapsed time for k point: 0.427542924881 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.404752016068 +elapsed time for k point: 0.91259598732 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -5807,7 +5876,7 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.28050303459 +total elapsed time for run: 7.56575298309 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -5850,90 +5919,90 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00290012359619 +elapsed time for initialization: 0.0123608112335 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... 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: 0.205606937408 +elapsed time for k point: 0.46830701828 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.602439165115 +elapsed time for k point: 1.30782103539 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.131309986115 +elapsed time for k point: 0.281880140305 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.120306015015 +elapsed time for k point: 0.259163856506 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.139186143875 +elapsed time for k point: 0.299006223679 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.219027996063 +elapsed time for k point: 0.464692115784 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.165324926376 +elapsed time for k point: 0.349982976913 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.140128850937 +elapsed time for k point: 0.297814130783 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.119776010513 +elapsed time for k point: 0.257199048996 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.115262031555 +elapsed time for k point: 0.250061988831 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.115461111069 +elapsed time for k point: 0.254423856735 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0909368991852 +elapsed time for k point: 0.20730304718 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.106294870377 +elapsed time for k point: 0.249104976654 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.144322156906 +elapsed time for k point: 0.332135915756 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.178783893585 +elapsed time for k point: 0.390784978867 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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 ./usr/lib/python2.7/dist-packages/scipy/optimize/_minimize.py:763: RuntimeWarning: Method 'bounded' does not support relative tolerance in x; defaulting to absolute tolerance. "defaulting to absolute tolerance.", RuntimeWarning) -elapsed time for k point: 0.359425783157 +elapsed time for k point: 0.815387964249 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -5945,9 +6014,9 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 2.95808005333 +total elapsed time for run: 6.49974107742 done -test_load_and_save_eigenvectors: 6.24s +test_load_and_save_eigenvectors: 14.07s test_maximize_first_tm_gap ======================== @@ -5992,92 +6061,92 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0023820400238 +elapsed time for initialization: 0.00746512413025 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... Finished solving for bands 2 to 2 after 16 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.457257 -elapsed time for k point: 0.00856614112854 +elapsed time for k point: 0.0277369022369 solve_kpoint (0.1,0,0): Solving for bands 1 to 2... 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: 0.0279669761658 +elapsed time for k point: 0.074343919754 solve_kpoint (0.2,0,0): Solving for bands 1 to 2... 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: 0.00889992713928 +elapsed time for k point: 0.0238151550293 solve_kpoint (0.3,0,0): Solving for bands 1 to 2... 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: 0.00904989242554 +elapsed time for k point: 0.0476751327515 solve_kpoint (0.4,0,0): Solving for bands 1 to 2... 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: 0.00806283950806 +elapsed time for k point: 0.0251619815826 solve_kpoint (0.5,0,0): Solving for bands 1 to 2... 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: 0.00809407234192 +elapsed time for k point: 0.0219938755035 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 2... 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: 0.00818800926208 +elapsed time for k point: 0.0365748405457 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 2... 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: 0.00827503204346 +elapsed time for k point: 0.0249118804932 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 2... 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: 0.00824213027954 +elapsed time for k point: 0.0227670669556 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 2... 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: 0.0091438293457 +elapsed time for k point: 0.0224690437317 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 2... 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: 0.00913500785828 +elapsed time for k point: 0.0246880054474 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 2... 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: 0.016175031662 +elapsed time for k point: 0.0487458705902 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 2... 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: 0.00877594947815 +elapsed time for k point: 0.0242538452148 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 2... 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: 0.0089590549469 +elapsed time for k point: 0.0237967967987 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 2... 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: 0.00972294807434 +elapsed time for k point: 0.0317640304565 solve_kpoint (0,0,0): Solving for bands 2 to 2... Finished solving for bands 2 to 2 after 12 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.457257 -elapsed time for k point: 0.00648903846741 +elapsed time for k point: 0.0197088718414 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.249029499922 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.351200835305 at Vector3<0.5, 0.0, 0.0> to 0.45725652119 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.249029499922) to band 2 (0.351200835305), 34.0440425572% -total elapsed time for run: 0.166736841202 +total elapsed time for run: 0.510521888733 done Initializing eigensolver data Computing 2 bands with 1e-12 tolerance @@ -6120,92 +6189,92 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00343012809753 +elapsed time for initialization: 0.00747990608215 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... Finished solving for bands 2 to 2 after 17 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.364215 -elapsed time for k point: 0.00932192802429 +elapsed time for k point: 0.0349941253662 solve_kpoint (0.1,0,0): Solving for bands 1 to 2... 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: 0.0256860256195 +elapsed time for k point: 0.107904911041 solve_kpoint (0.2,0,0): Solving for bands 1 to 2... 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: 0.00911092758179 +elapsed time for k point: 0.0348529815674 solve_kpoint (0.3,0,0): Solving for bands 1 to 2... 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: 0.00901293754578 +elapsed time for k point: 0.0369248390198 solve_kpoint (0.4,0,0): Solving for bands 1 to 2... 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: 0.00880289077759 +elapsed time for k point: 0.0279080867767 solve_kpoint (0.5,0,0): Solving for bands 1 to 2... 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: 0.00798106193542 +elapsed time for k point: 0.0216789245605 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 2... 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: 0.00798988342285 +elapsed time for k point: 0.0581769943237 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 2... 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: 0.00806283950806 +elapsed time for k point: 0.0918610095978 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 2... 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: 0.0078489780426 +elapsed time for k point: 0.0838940143585 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 2... 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: 0.00872182846069 +elapsed time for k point: 0.0879120826721 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 2... 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: 0.0089898109436 +elapsed time for k point: 0.0879461765289 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 2... 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: 0.020073890686 +elapsed time for k point: 0.091864824295 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 2... 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: 0.00873708724976 +elapsed time for k point: 0.0329661369324 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 2... 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: 0.00893807411194 +elapsed time for k point: 0.0628991127014 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 2... Finished solving for bands 1 to 2 after 9 iterations. tmfreqs:, 15, 0.1, 0.1, 0, 0.141421, 0.0617389, 0.353456 -elapsed time for k point: 0.00892615318298 +elapsed time for k point: 0.0718760490417 solve_kpoint (0,0,0): Solving for bands 2 to 2... Finished solving for bands 2 to 2 after 13 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.364216 -elapsed time for k point: 0.00697302818298 +elapsed time for k point: 0.0240361690521 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.218622569105 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.259996144375 at Vector3<0.5, 0.0, 0.0> to 0.364215520346 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.218622569105) to band 2 (0.259996144375), 17.2887411647% -total elapsed time for run: 0.169190883636 +total elapsed time for run: 0.966804027557 done Initializing eigensolver data Computing 2 bands with 1e-12 tolerance @@ -6248,92 +6317,92 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00237107276917 +elapsed time for initialization: 0.00468015670776 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... Finished solving for bands 2 to 2 after 20 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.546124 -elapsed time for k point: 0.0108380317688 +elapsed time for k point: 0.0278120040894 solve_kpoint (0.1,0,0): Solving for bands 1 to 2... 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: 0.0151119232178 +elapsed time for k point: 0.0748760700226 solve_kpoint (0.2,0,0): Solving for bands 1 to 2... 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: 0.00960612297058 +elapsed time for k point: 0.0598890781403 solve_kpoint (0.3,0,0): Solving for bands 1 to 2... 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: 0.00895094871521 +elapsed time for k point: 0.0439159870148 solve_kpoint (0.4,0,0): Solving for bands 1 to 2... 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: 0.00786089897156 +elapsed time for k point: 0.0399158000946 solve_kpoint (0.5,0,0): Solving for bands 1 to 2... 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: 0.00796413421631 +elapsed time for k point: 0.0359098911285 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 2... 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: 0.00796008110046 +elapsed time for k point: 0.0479500293732 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 2... 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: 0.00811004638672 +elapsed time for k point: 0.0359060764313 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 2... 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: 0.00785303115845 +elapsed time for k point: 0.0478839874268 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 2... 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: 0.00870013237 +elapsed time for k point: 0.0519421100616 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 2... 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: 0.00869011878967 +elapsed time for k point: 0.0678858757019 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 2... 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: 0.0159049034119 +elapsed time for k point: 0.0798738002777 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 2... 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: 0.00878214836121 +elapsed time for k point: 0.0264840126038 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 2... 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: 0.00976586341858 +elapsed time for k point: 0.0286099910736 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 2... 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: 0.0104820728302 +elapsed time for k point: 0.0290770530701 solve_kpoint (0,0,0): Solving for bands 2 to 2... Finished solving for bands 2 to 2 after 16 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.546124 -elapsed time for k point: 0.00845289230347 +elapsed time for k point: 0.0275490283966 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.285403810579 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.424115051619 at Vector3<0.5, 0.0, 0.0> to 0.546124486861 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.285403810579) to band 2 (0.424115051619), 39.1000855456% -total elapsed time for run: 0.157923936844 +total elapsed time for run: 0.731631040573 done Initializing eigensolver data Computing 2 bands with 1e-12 tolerance @@ -6376,94 +6445,94 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00256109237671 +elapsed time for initialization: 0.00393891334534 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... Finished solving for bands 2 to 2 after 14 iterations. tmfreqs:, 1, 0, 0, 0, 0, 0, 0.550087 -elapsed time for k point: 0.00789403915405 +elapsed time for k point: 0.0205490589142 solve_kpoint (0.1,0,0): Solving for bands 1 to 2... 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: 0.0097918510437 +elapsed time for k point: 0.0350139141083 solve_kpoint (0.2,0,0): Solving for bands 1 to 2... 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: 0.0103371143341 +elapsed time for k point: 0.0301940441132 solve_kpoint (0.3,0,0): Solving for bands 1 to 2... 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: 0.00990104675293 +elapsed time for k point: 0.0263638496399 solve_kpoint (0.4,0,0): Solving for bands 1 to 2... 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: 0.00890398025513 +elapsed time for k point: 0.0227658748627 solve_kpoint (0.5,0,0): Solving for bands 1 to 2... 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: 0.00792694091797 +elapsed time for k point: 0.0220119953156 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 2... 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: 0.00816106796265 +elapsed time for k point: 0.0203258991241 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 2... 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: 0.0080771446228 +elapsed time for k point: 0.0204749107361 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 2... 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: 0.00800490379333 +elapsed time for k point: 0.0293970108032 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 2... 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: 0.00973415374756 +elapsed time for k point: 0.0358610153198 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 2... 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: 0.0098090171814 +elapsed time for k point: 0.030611038208 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 2... 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: 0.0161440372467 +elapsed time for k point: 0.0429308414459 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 2... 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: 0.00889110565186 +elapsed time for k point: 0.0382127761841 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 2... 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: 0.00972080230713 +elapsed time for k point: 0.0329399108887 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 2... 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: 0.0098831653595 +elapsed time for k point: 0.0290431976318 solve_kpoint (0,0,0): Solving for bands 2 to 2... Finished solving for bands 2 to 2 after 12 iterations. tmfreqs:, 16, 0, 0, 0, 0, 0, 0.550087 -.elapsed time for k point: 0.00644707679749 +.elapsed time for k point: 0.015988111496 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.317444122972 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4615121899 at Vector3<0.5, 0.0, 0.0> to 0.582277810582 at Vector3<0.5, 0.5, 0.0> Gap from band 1 (0.317444122972) to band 2 (0.4615121899), 36.9900248696% -total elapsed time for run: 0.152686834335 +total elapsed time for run: 0.458019018173 done -test_maximize_first_tm_gap: 0.65s +test_maximize_first_tm_gap: 2.67s test_multiply_bloch_in_map_data ======================== @@ -6508,88 +6577,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00277185440063 +elapsed time for initialization: 0.00501704216003 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... 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: 0.223722934723 +elapsed time for k point: 0.574119091034 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.657801866531 +elapsed time for k point: 1.46362090111 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.144073009491 +elapsed time for k point: 0.324166059494 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.132134914398 +elapsed time for k point: 0.383780002594 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.154812097549 +elapsed time for k point: 0.36785197258 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.239145040512 +elapsed time for k point: 0.587880849838 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.17990398407 +elapsed time for k point: 0.491811037064 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.153857946396 +elapsed time for k point: 0.363971948624 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.133374929428 +elapsed time for k point: 0.335916996002 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.128076076508 +elapsed time for k point: 0.296207904816 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.126335859299 +elapsed time for k point: 0.275346040726 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.101249933243 +elapsed time for k point: 0.22417807579 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.11537194252 +elapsed time for k point: 0.257165908813 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.157356023788 +elapsed time for k point: 0.430302858353 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.186570882797 +elapsed time for k point: 0.439869165421 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.396667957306 +elapsed time for k point: 0.867788791656 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -6601,7 +6670,7 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.23481202126 +total elapsed time for run: 7.69161200523 done Fixing e-field (band 8) phase by -2.6145e-07 + -1i; max ampl. = 1.10099 Initializing eigensolver data @@ -6645,88 +6714,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00292801856995 +elapsed time for initialization: 0.164875030518 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... 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: 0.206003189087 +elapsed time for k point: 0.51345705986 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.598357915878 +elapsed time for k point: 1.33923983574 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.132280826569 +elapsed time for k point: 0.368512153625 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.122144937515 +elapsed time for k point: 0.275158882141 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.141844987869 +elapsed time for k point: 0.318150043488 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.222188949585 +elapsed time for k point: 0.554282188416 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.165068864822 +elapsed time for k point: 0.463828086853 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.141752004623 +elapsed time for k point: 0.407867908478 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.12141919136 +elapsed time for k point: 0.279778003693 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.117040872574 +elapsed time for k point: 0.303870201111 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.116138935089 +elapsed time for k point: 0.319993019104 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0935180187225 +elapsed time for k point: 0.230962991714 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.10585808754 +elapsed time for k point: 0.231934070587 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.144087076187 +elapsed time for k point: 0.313222885132 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.170542001724 +elapsed time for k point: 0.383330106735 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.360208034515 +elapsed time for k point: 0.831834793091 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -6738,10 +6807,10 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 2.96295619011 +total elapsed time for run: 7.30282092094 done Fixing e-field (band 8) phase by -2.6145e-07 + -1i; max ampl. = 1.10099 -.test_multiply_bloch_in_map_data: 6.28s +.test_multiply_bloch_in_map_data: 15.20s test_multiply_bloch_phase ======================== @@ -6786,88 +6855,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0027220249176 +elapsed time for initialization: 0.0711829662323 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... 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: 0.203696012497 +elapsed time for k point: 0.461328983307 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.606100082397 +elapsed time for k point: 1.45849704742 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.131839990616 +elapsed time for k point: 0.371768951416 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.121634960175 +elapsed time for k point: 0.351922988892 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.141407012939 +elapsed time for k point: 0.391794919968 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.217532873154 +elapsed time for k point: 0.488344907761 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.166371822357 +elapsed time for k point: 0.35130405426 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.140883922577 +elapsed time for k point: 0.302478075027 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.120865821838 +elapsed time for k point: 0.337200880051 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.116704940796 +elapsed time for k point: 0.283765077591 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.115836143494 +elapsed time for k point: 0.273436069489 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0946478843689 +elapsed time for k point: 0.194794893265 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.1085460186 +elapsed time for k point: 0.255399942398 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.145819187164 +elapsed time for k point: 0.320095062256 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.171627044678 +elapsed time for k point: 0.443524122238 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.361511945724 +elapsed time for k point: 0.843793153763 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -6879,10 +6948,10 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 2.9693338871 +total elapsed time for run: 7.20351600647 done Fixing e-field (band 8) phase by -2.6145e-07 + -1i; max ampl. = 1.10099 -.test_multiply_bloch_phase: 2.97s +.test_multiply_bloch_phase: 7.22s test_output_charge_density ======================== @@ -6927,88 +6996,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00279188156128 +elapsed time for initialization: 0.00714111328125 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... 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: 0.20560503006 +elapsed time for k point: 0.423877000809 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.5992000103 +elapsed time for k point: 1.3159661293 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.131423950195 +elapsed time for k point: 0.309321880341 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.120308876038 +elapsed time for k point: 0.262258052826 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.142133951187 +elapsed time for k point: 0.303555011749 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.223321914673 +elapsed time for k point: 0.548267126083 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.16533780098 +elapsed time for k point: 0.459779024124 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.141242027283 +elapsed time for k point: 0.403867006302 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.12101483345 +elapsed time for k point: 0.311851978302 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.115401029587 +elapsed time for k point: 0.258731842041 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.114833116531 +elapsed time for k point: 0.253005027771 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0913050174713 +elapsed time for k point: 0.283913850784 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.108274936676 +elapsed time for k point: 0.315857172012 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.146981954575 +elapsed time for k point: 0.375896215439 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.172666072845 +elapsed time for k point: 0.399822950363 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.360588788986 +elapsed time for k point: 0.767925977707 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -7020,11 +7089,11 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 2.9640250206 +total elapsed time for run: 7.00361514091 done Fixing e-field (band 8) phase by -2.6145e-07 + -1i; max ampl. = 1.10099 .Outputting complex scalar field to test_output_charge_density-C.k16.b08.te.h5... -test_output_charge_density: 2.97s +test_output_charge_density: 7.12s test_output_dpwr_in_objects ======================== @@ -7069,13 +7138,13 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00265097618103 +elapsed time for initialization: 0.132987976074 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... 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: 0.204178094864 +elapsed time for k point: 0.425939798355 D-energy-components:, 1, 1, 0, 0, 0 dpwr:, 1, 0.0, 0.0 D-energy-components:, 1, 2, 0.500003, 0.499997, 0 @@ -7097,7 +7166,7 @@ Solving for bands 1 to 8... 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: 0.600843191147 +elapsed time for k point: 1.32060980797 D-energy-components:, 2, 1, 0.0311142, 0.968886, 0 dpwr:, 1, 0.0897332260527, 0.0460317691625 D-energy-components:, 2, 2, 0.488088, 0.511912, 0 @@ -7118,7 +7187,7 @@ Solving for bands 1 to 8... 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: 0.130686998367 +elapsed time for k point: 0.375085115433 D-energy-components:, 3, 1, 0.0363561, 0.963644, 0 dpwr:, 1, 0.178692004464, 0.0544220726352 D-energy-components:, 3, 2, 0.446363, 0.553637, 0 @@ -7139,7 +7208,7 @@ Solving for bands 1 to 8... 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: 0.122485160828 +elapsed time for k point: 0.287275075912 D-energy-components:, 4, 1, 0.0468976, 0.953102, 0 dpwr:, 1, 0.265797606716, 0.0718902112943 D-energy-components:, 4, 2, 0.35602, 0.64398, 0 @@ -7160,7 +7229,7 @@ Solving for bands 1 to 8... 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: 0.142019033432 +elapsed time for k point: 0.408826112747 D-energy-components:, 5, 1, 0.0662302, 0.93377, 0 dpwr:, 1, 0.348955949925, 0.103845244711 D-energy-components:, 5, 2, 0.226367, 0.773633, 0 @@ -7181,7 +7250,7 @@ Solving for bands 1 to 8... 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: 0.21854186058 +elapsed time for k point: 0.491470098495 D-energy-components:, 6, 1, 0.0773009, 0.922699, 0 dpwr:, 1, 0.412790671265, 0.0860399668631 D-energy-components:, 6, 2, 0.165167, 0.834833, 0 @@ -7202,7 +7271,7 @@ Solving for bands 1 to 8... 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: 0.165891885757 +elapsed time for k point: 0.355230093002 D-energy-components:, 7, 1, 0.12807, 0.87193, 0 dpwr:, 1, 0.423741461324, 0.0840529271234 D-energy-components:, 7, 2, 0.190236, 0.809764, 0 @@ -7223,7 +7292,7 @@ Solving for bands 1 to 8... 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: 0.13937997818 +elapsed time for k point: 0.315382957458 D-energy-components:, 8, 1, 0.253956, 0.746044, 0 dpwr:, 1, 0.454781272515, 0.0802008373372 D-energy-components:, 8, 2, 0.258536, 0.741464, 0 @@ -7244,7 +7313,7 @@ Solving for bands 1 to 8... 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: 0.119608879089 +elapsed time for k point: 0.264993906021 D-energy-components:, 9, 1, 0.353246, 0.646754, 0 dpwr:, 1, 0.473766595936, 0.512582772213 D-energy-components:, 9, 2, 0.406264, 0.593736, 0 @@ -7265,7 +7334,7 @@ Solving for bands 1 to 8... 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: 0.118331193924 +elapsed time for k point: 0.268463850021 D-energy-components:, 10, 1, 0.450645, 0.549355, 0 dpwr:, 1, 0.48964920033, 0.628546937162 D-energy-components:, 10, 2, 0.55965, 0.44035, 0 @@ -7286,7 +7355,7 @@ Solving for bands 1 to 8... 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: 0.116771936417 +elapsed time for k point: 0.250375986099 D-energy-components:, 11, 1, 0.500002, 0.499998, 0 dpwr:, 1, 0.496835864745, 0.698636026235 D-energy-components:, 11, 2, 0.490408, 0.509592, 0 @@ -7307,7 +7376,7 @@ Solving for bands 1 to 8... 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: 0.0923969745636 +elapsed time for k point: 0.207095146179 D-energy-components:, 12, 1, 0.500001, 0.499999, 0 dpwr:, 1, 0.470986895443, 0.418457310179 D-energy-components:, 12, 2, 0.5, 0.5, 0 @@ -7328,7 +7397,7 @@ Solving for bands 1 to 8... 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: 0.107418060303 +elapsed time for k point: 0.239716053009 D-energy-components:, 13, 1, 0.499999, 0.500001, 0 dpwr:, 1, 0.372434676913, 0.122374083381 D-energy-components:, 13, 2, 0.500002, 0.499998, 0 @@ -7349,7 +7418,7 @@ Solving for bands 1 to 8... 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: 0.147063016891 +elapsed time for k point: 0.332632064819 D-energy-components:, 14, 1, 0.499999, 0.500001, 0 dpwr:, 1, 0.252088096229, 0.0653722298843 D-energy-components:, 14, 2, 0.500003, 0.499997, 0 @@ -7370,7 +7439,7 @@ Solving for bands 1 to 8... 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: 0.171612977982 +elapsed time for k point: 0.378603219986 D-energy-components:, 15, 1, 0.499999, 0.500001, 0 dpwr:, 1, 0.126841069035, 0.0479527977034 D-energy-components:, 15, 2, 0.500003, 0.499997, 0 @@ -7391,7 +7460,7 @@ Solving for bands 2 to 8... 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: 0.364959001541 +elapsed time for k point: 0.816428899765 D-energy-components:, 16, 1, 0, 0, 0 dpwr:, 1, 0.0, 0.0 D-energy-components:, 16, 2, 0.500003, 0.499997, 0 @@ -7420,9 +7489,9 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.10589694977 +total elapsed time for run: 8.20242094994 done -test_output_dpwr_in_objects: 3.11s +test_output_dpwr_in_objects: 8.21s test_output_efield_z ======================== @@ -7467,88 +7536,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00266194343567 +elapsed time for initialization: 0.0373771190643 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... 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: 0.240501880646 +elapsed time for k point: 0.581901073456 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.117403030396 +elapsed time for k point: 0.271865129471 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.0663938522339 +elapsed time for k point: 0.223886966705 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.0683357715607 +elapsed time for k point: 0.179799079895 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.0676989555359 +elapsed time for k point: 0.163944959641 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.0676279067993 +elapsed time for k point: 0.187940120697 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.0631959438324 +elapsed time for k point: 0.151851892471 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.0577669143677 +elapsed time for k point: 0.17189002037 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.0638468265533 +elapsed time for k point: 0.16797208786 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.0733890533447 +elapsed time for k point: 0.167798995972 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.077644109726 +elapsed time for k point: 0.176623106003 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0824329853058 +elapsed time for k point: 0.187156915665 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.062164068222 +elapsed time for k point: 0.140368938446 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.0628480911255 +elapsed time for k point: 0.133152008057 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.0738801956177 +elapsed time for k point: 0.21420788765 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.233824014664 +elapsed time for k point: 0.575752019882 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.280947953525 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.417114249325 at Vector3<0.5, 0.0, 0.0> to 0.546026779337 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.496197452765 at Vector3<0.5, 0.5, 0.0> to 0.557657636298 at Vector3<0.5, 0.0, 0.0> @@ -7559,11 +7628,11 @@ Band 8 range: 0.879351095829 at Vector3<0.5, 0.5, 0.0> to 1.08259238415 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.280947953525) to band 2 (0.417114249325), 39.0126539564% Gap from band 4 (0.713395151642) to band 5 (0.741310965707), 3.83800050492% -total elapsed time for run: 1.48315596581 +total elapsed time for run: 3.73568582535 done Fixing e-field (band 8) phase by -2.43258e-08 + 1i; max ampl. = 1.49941 FOutputting fields to test_output_efield_z-e.k16.b08.z.tm.h5... -test_output_efield_z: 1.49s +test_output_efield_z: 3.79s test_output_field_to_file ======================== @@ -7608,88 +7677,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00287699699402 +elapsed time for initialization: 0.00527191162109 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... 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: 0.205022096634 +elapsed time for k point: 0.472363948822 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.607813835144 +elapsed time for k point: 1.3177690506 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.131798028946 +elapsed time for k point: 0.283303022385 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.123873949051 +elapsed time for k point: 0.289543867111 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.141836881638 +elapsed time for k point: 0.315720081329 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.219459056854 +elapsed time for k point: 0.484033107758 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.167134046555 +elapsed time for k point: 0.43586397171 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.142445087433 +elapsed time for k point: 0.40783905983 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.121710062027 +elapsed time for k point: 0.290312051773 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.117214918137 +elapsed time for k point: 0.253057003021 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.117774009705 +elapsed time for k point: 0.302735090256 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0942730903625 +elapsed time for k point: 0.206999063492 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.108839035034 +elapsed time for k point: 0.252889156342 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.145919084549 +elapsed time for k point: 0.399578809738 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.171780109406 +elapsed time for k point: 0.483873844147 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.365921020508 +elapsed time for k point: 0.827870845795 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -7701,11 +7770,11 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 2.98732089996 +total elapsed time for run: 7.03313183784 done epsilon: 1-12, mean 2.38229, harm. mean 1.1448, 14.5508% > 1, 12.5663% "fill" .Outputting test_output_field_to_file-epsilon.h5... -test_output_field_to_file: 3.00s +test_output_field_to_file: 7.12s test_output_tot_pwr ======================== @@ -7750,88 +7819,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00273108482361 +elapsed time for initialization: 0.0289449691772 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... 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: 0.207875967026 +elapsed time for k point: 0.424022197723 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.606066942215 +elapsed time for k point: 1.29781293869 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.134074926376 +elapsed time for k point: 0.288364171982 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.12202501297 +elapsed time for k point: 0.347438097 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.14129781723 +elapsed time for k point: 0.338968992233 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.221169948578 +elapsed time for k point: 0.504735946655 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.168643951416 +elapsed time for k point: 0.451853990555 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.142757177353 +elapsed time for k point: 0.379796028137 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.121644020081 +elapsed time for k point: 0.279958963394 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.115636110306 +elapsed time for k point: 0.257215023041 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.115041017532 +elapsed time for k point: 0.262239933014 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0927259922028 +elapsed time for k point: 0.216192007065 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.107490777969 +elapsed time for k point: 0.315937995911 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.144986867905 +elapsed time for k point: 0.407782077789 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.171294212341 +elapsed time for k point: 0.407916069031 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.364194869995 +elapsed time for k point: 0.7708568573 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -7843,14 +7912,14 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 2.9812130928 +total elapsed time for run: 6.98219799995 done D-energy-components:, 16, 8, 0.499991, 0.500009, 0 B-energy-components:, 16, 8, 0, 0, 1 Outputting test_output_tot_pwr-tot.rpwr.k16.b08.te.h5... D-energy-components:, 16, 8, 0.499991, 0.500009, 0 B-energy-components:, 16, 8, 0, 0, 1 -.test_output_tot_pwr: 2.99s +.test_output_tot_pwr: 6.99s test_point_defect_state ======================== @@ -7930,29 +7999,40 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0350971221924 +elapsed time for initialization: 0.073292016983 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... + iteration 28: trace = 0.2502955162302463 (9.00364e-08% change) Finished solving for bands 1 to 10 after 38 iterations. Solving for bands 11 to 20... + iteration 23: trace = 0.5523044156387964 (9.55098e-09% change) Finished solving for bands 11 to 20 after 28 iterations. Solving for bands 21 to 30... - iteration 48: trace = 1.368743567920005 (7.24761e-06% change) - iteration 96: trace = 1.368731164439944 (9.62705e-07% change) - iteration 144: trace = 1.368730820978168 (2.11225e-08% change) + iteration 22: trace = 1.368783116284512 (0.000892725% change) + iteration 43: trace = 1.368743837482322 (1.35857e-06% change) + iteration 65: trace = 1.368731784400659 (2.33252e-05% change) + iteration 87: trace = 1.368731192446026 (3.60894e-08% change) + iteration 109: trace = 1.368731048989892 (3.77944e-09% change) + iteration 131: trace = 1.368730882020894 (2.76406e-06% change) + iteration 153: trace = 1.368730819287369 (3.48125e-08% change) + iteration 175: trace = 1.368730785425631 (6.47609e-11% change) Finished solving for bands 21 to 30 after 175 iterations. Solving for bands 31 to 40... - iteration 43: trace = 2.150317369682118 (0.00011492% change) - iteration 87: trace = 2.150313166583269 (3.63381e-09% change) + iteration 20: trace = 2.150656548347154 (0.00775263% change) + iteration 40: trace = 2.150328828095616 (0.000298383% change) + iteration 60: trace = 2.150313170311313 (1.43445e-08% change) + iteration 80: trace = 2.150313167392917 (3.25858e-09% change) Finished solving for bands 31 to 40 after 94 iterations. Solving for bands 41 to 50... - iteration 37: trace = 2.434024951062724 (2.05376e-05% change) + iteration 18: trace = 2.435606081496116 (0.0337179% change) + iteration 35: trace = 2.434026138700993 (3.07266e-05% change) + iteration 52: trace = 2.434024313235235 (1.45915e-08% change) 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: 34.8590788841 -total elapsed time for run: 34.8946239948 +elapsed time for k point: 78.0094840527 +total elapsed time for run: 78.0833449364 done Fixing e-field (band 25) phase by 0.24413 + 0.969742i; max ampl. = 0.816569 Outputting fields to test_point_defect_state-e.k01.b25.z.tm.h5... @@ -8035,14 +8115,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0180130004883 +elapsed time for initialization: 0.0346779823303 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.19388699532 -total elapsed time for run: 1.21202993393 +elapsed time for k point: 2.64074015617 +total elapsed time for run: 2.67554497719 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -8123,14 +8203,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0179748535156 +elapsed time for initialization: 0.210966110229 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.20806503296 -total elapsed time for run: 1.22612595558 +elapsed time for k point: 2.65636205673 +total elapsed time for run: 2.86743402481 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -8211,14 +8291,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0183119773865 +elapsed time for initialization: 0.0278549194336 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.53078103065 -total elapsed time for run: 1.54918599129 +elapsed time for k point: 3.07206392288 +total elapsed time for run: 3.10003399849 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -8299,14 +8379,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0179839134216 +elapsed time for initialization: 0.0514550209045 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.07887196541 -total elapsed time for run: 1.09694719315 +elapsed time for k point: 2.6738088131 +total elapsed time for run: 2.72537612915 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -8387,14 +8467,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0183439254761 +elapsed time for initialization: 0.0967121124268 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.07817292213 -total elapsed time for run: 1.09662103653 +elapsed time for k point: 2.21188783646 +total elapsed time for run: 2.30876708031 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -8475,14 +8555,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0187909603119 +elapsed time for initialization: 0.208611965179 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.09785103798 -total elapsed time for run: 1.11674904823 +elapsed time for k point: 2.34944796562 +total elapsed time for run: 2.55816912651 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -8563,14 +8643,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0191230773926 +elapsed time for initialization: 0.0290169715881 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.16400098801 -total elapsed time for run: 1.18321108818 +elapsed time for k point: 2.86442995071 +total elapsed time for run: 2.89358496666 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -8651,14 +8731,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0183441638947 +elapsed time for initialization: 0.105715990067 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.05304718018 -total elapsed time for run: 1.07148194313 +elapsed time for k point: 2.6821141243 +total elapsed time for run: 2.78801083565 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -8739,14 +8819,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0180850028992 +elapsed time for initialization: 0.161021947861 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.1447660923 -total elapsed time for run: 1.16294908524 +elapsed time for k point: 2.37858891487 +total elapsed time for run: 2.53972887993 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -8827,14 +8907,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0182931423187 +elapsed time for initialization: 0.0828640460968 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.02165102959 -total elapsed time for run: 1.04004406929 +elapsed time for k point: 2.74901199341 +total elapsed time for run: 2.8320441246 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -8915,14 +8995,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0180990695953 +elapsed time for initialization: 0.129222869873 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.14113092422 -total elapsed time for run: 1.15933704376 +elapsed time for k point: 2.32517004013 +total elapsed time for run: 2.45451211929 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -9003,14 +9083,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0184230804443 +elapsed time for initialization: 0.146511077881 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.10789895058 -total elapsed time for run: 1.12645292282 +elapsed time for k point: 2.89186000824 +total elapsed time for run: 3.03847908974 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -9091,14 +9171,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0191180706024 +elapsed time for initialization: 0.043468952179 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.16560292244 -total elapsed time for run: 1.18481016159 +elapsed time for k point: 2.34712290764 +total elapsed time for run: 2.39073395729 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -9179,14 +9259,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0185759067535 +elapsed time for initialization: 0.216876029968 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... Finished solving for bands 1 to 1 after 138 iterations. tmfreqs:, 1, 0.5, 0.5, 0, 0.141421, 0.313822 -elapsed time for k point: 1.0564930439 -total elapsed time for run: 1.0751619339 +elapsed time for k point: 2.78441500664 +total elapsed time for run: 3.00140619278 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -9267,14 +9347,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0180439949036 +elapsed time for initialization: 0.0994417667389 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.15788197517 -total elapsed time for run: 1.17602586746 +elapsed time for k point: 2.37877392769 +total elapsed time for run: 2.47832679749 done Initializing eigensolver data Computing 1 bands with 1e-08 tolerance @@ -9355,16 +9435,16 @@ Initializing fields to random numbers... 1 k-points Vector3<0.5, 0.5, 0.0> -elapsed time for initialization: 0.0180151462555 +elapsed time for initialization: 0.0570321083069 solve_kpoint (0.5,0.5,0): tmfreqs:, k index, k1, k2, k3, kmag/2pi, tm band 1 Solving for bands 1 to 1... 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: 1.06410098076 -total elapsed time for run: 1.08220601082 +.elapsed time for k point: 2.90284204483 +total elapsed time for run: 2.960034132 done -test_point_defect_state: 53.48s +test_point_defect_state: 121.75s test_poynting ======================== @@ -9409,63 +9489,63 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00290894508362 +elapsed time for initialization: 0.0112011432648 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... 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: 0.204222917557 +elapsed time for k point: 0.576266050339 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.599160194397 +elapsed time for k point: 1.53988003731 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.131900072098 +elapsed time for k point: 0.419870853424 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.121649026871 +elapsed time for k point: 0.34365606308 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.138956069946 +elapsed time for k point: 0.435765028 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.218085765839 +elapsed time for k point: 0.619740009308 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.165874958038 +elapsed time for k point: 0.491793870926 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.139708995819 +elapsed time for k point: 0.435645103455 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.120186090469 +elapsed time for k point: 0.335858106613 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.114773988724 +elapsed time for k point: 0.303788900375 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.116826057434 +elapsed time for k point: 0.331690073013 Outputting fields to test_poynting-flux.v.k11.b01.te.h5... Outputting fields to test_poynting-flux.v.k11.b02.te.h5... Outputting fields to test_poynting-flux.v.k11.b03.te.h5... @@ -9478,27 +9558,27 @@ Solving for bands 1 to 8... 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: 0.0937979221344 +elapsed time for k point: 0.317909955978 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.108546972275 +elapsed time for k point: 0.379774808884 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.148073911667 +elapsed time for k point: 0.379672050476 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.175863981247 +elapsed time for k point: 0.487722873688 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.365591049194 +..elapsed time for k point: 0.84841799736 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -9510,9 +9590,9 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.14924502373 +total elapsed time for run: 9.02055501938 done -test_poynting: 3.16s +test_poynting: 9.05s test_resolution ======================== @@ -9561,88 +9641,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00273084640503 +elapsed time for initialization: 0.0346710681915 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... 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: 0.207125902176 +elapsed time for k point: 0.553828001022 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.607124090195 +elapsed time for k point: 1.40261912346 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.132333993912 +elapsed time for k point: 0.369220972061 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.122846126556 +elapsed time for k point: 0.315753936768 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.143126964569 +elapsed time for k point: 0.329247951508 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.218825101852 +elapsed time for k point: 0.534692049026 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.166624069214 +elapsed time for k point: 0.479552030563 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.140950918198 +elapsed time for k point: 0.348351955414 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.121128082275 +elapsed time for k point: 0.363305091858 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.116022109985 +elapsed time for k point: 0.375855922699 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.114947080612 +elapsed time for k point: 0.343936920166 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.093955039978 +elapsed time for k point: 0.311718940735 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.10724902153 +elapsed time for k point: 0.280977010727 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.146383047104 +elapsed time for k point: 0.374768972397 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.17130112648 +elapsed time for k point: 0.444000005722 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.362483024597 +.elapsed time for k point: 0.847706079483 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -9654,9 +9734,9 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 2.9768910408 +total elapsed time for run: 7.7127840519 done -test_run_te: 2.98s +test_run_te: 7.71s test_run_te_no_geometry ======================== @@ -9699,88 +9779,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00150513648987 +elapsed time for initialization: 0.00841188430786 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... 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: 0.034884929657 +elapsed time for k point: 0.152985811234 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.0143208503723 +elapsed time for k point: 0.0439949035645 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.00879907608032 +elapsed time for k point: 0.0203239917755 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.00879096984863 +elapsed time for k point: 0.0192639827728 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.00888299942017 +elapsed time for k point: 0.0359148979187 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.00857090950012 +elapsed time for k point: 0.031779050827 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.0136859416962 +elapsed time for k point: 0.0351450443268 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.0136950016022 +elapsed time for k point: 0.0446109771729 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.0426230430603 +elapsed time for k point: 0.106494188309 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.00852394104004 +elapsed time for k point: 0.0217230319977 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.00856399536133 +elapsed time for k point: 0.0215239524841 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.378756999969 +elapsed time for k point: 0.92586016655 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.00863409042358 +elapsed time for k point: 0.0758540630341 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.00872683525085 +elapsed time for k point: 0.119779109955 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.00861978530884 +elapsed time for k point: 0.0478210449219 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.00703597068787 +.elapsed time for k point: 0.0319240093231 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.707106781187 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.500000000035 at Vector3<0.5, 0.0, 0.0> to 1.00000000005 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.707106781188 at Vector3<0.5, 0.5, 0.0> to 1.11803398876 at Vector3<0.5, 0.0, 0.0> @@ -9789,9 +9869,9 @@ Band 6 range: 1.11803398877 at Vector3<0.5, 0.0, 0.0> to 1.58113883009 at Vector3<0.5, 0.5, 0.0> Band 7 range: 1.28062484752 at Vector3<0.2, 0.0, 0.0> to 1.58113883009 at Vector3<0.5, 0.5, 0.0> Band 8 range: 1.41421356238 at Vector3<0.0, 0.0, 0.0> to 1.80277563765 at Vector3<0.5, 0.0, 0.0> -total elapsed time for run: 0.585664987564 +total elapsed time for run: 1.74563717842 done -test_run_te_no_geometry: 0.59s +test_run_te_no_geometry: 1.75s test_run_te_with_mu_material ======================== @@ -9837,88 +9917,89 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00464296340942 +elapsed time for initialization: 0.0197250843048 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... 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: 1.2888250351 +elapsed time for k point: 2.65344905853 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... Finished solving for bands 1 to 8 after 152 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: 1.22468209267 +elapsed time for k point: 2.82780694962 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... Finished solving for bands 1 to 8 after 107 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: 0.862150907516 +elapsed time for k point: 1.95595097542 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... Finished solving for bands 1 to 8 after 101 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: 0.821475028992 +elapsed time for k point: 1.85588502884 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... Finished solving for bands 1 to 8 after 210 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: 1.69347882271 +elapsed time for k point: 3.69040417671 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.623854875565 +elapsed time for k point: 1.39733195305 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.702759027481 +elapsed time for k point: 1.58126401901 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.822185993195 +elapsed time for k point: 1.83855104446 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.995059967041 +elapsed time for k point: 2.47579288483 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... + iteration 226: trace = 6.642839444633212 (0.00807281% change) Finished solving for bands 1 to 8 after 329 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: 2.65600419044 +elapsed time for k point: 6.01594185829 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.562261104584 +elapsed time for k point: 1.34783101082 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.784685850143 +elapsed time for k point: 1.80957508087 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... Finished solving for bands 1 to 8 after 128 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: 1.02657294273 +elapsed time for k point: 2.3141310215 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... Finished solving for bands 1 to 8 after 110 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: 0.887079000473 +elapsed time for k point: 1.92250394821 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 1.02128577232 +elapsed time for k point: 2.25329113007 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.835592031479 +elapsed time for k point: 1.99566102028 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.416529123304 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.473282323487 at Vector3<0.5, 0.0, 0.0> to 0.669986728129 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.630180264682 at Vector3<0.5, 0.5, 0.0> to 0.803736532303 at Vector3<0.5, 0.0, 0.0> @@ -9929,12 +10010,12 @@ Band 8 range: 1.20597286367 at Vector3<0.0, 0.0, 0.0> to 1.31350625236 at Vector3<0.3, 0.0, 0.0> Gap from band 1 (0.416529123304) to band 2 (0.473282323487), 12.7562306347% Gap from band 4 (0.886344816771) to band 5 (0.904749848581), 2.05517130567% -total elapsed time for run: 16.8143420219 +total elapsed time for run: 37.9576489925 done mu: 1-5, mean 1.50265, harm. mean 1.12084, 14.5508% > 1, 12.5663% "fill" Outputting test_run_te_with_mu_material-mu.h5... mu: 1-5, mean 1.50265, harm. mean 1.12084, 14.5508% > 1, 12.5663% "fill" -.test_run_te_with_mu_material: 16.82s +.test_run_te_with_mu_material: 38.03s test_run_tm ======================== @@ -9979,88 +10060,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00269484519958 +elapsed time for initialization: 0.0322160720825 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... 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: 0.248328924179 +elapsed time for k point: 0.582577943802 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.118008136749 +elapsed time for k point: 0.291630983353 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.0672650337219 +elapsed time for k point: 0.275865793228 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.0666921138763 +elapsed time for k point: 0.279846906662 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.0680651664734 +elapsed time for k point: 0.199820041656 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.0688400268555 +elapsed time for k point: 0.243826150894 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.0668268203735 +elapsed time for k point: 0.259855985641 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.0581591129303 +elapsed time for k point: 0.271810054779 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.0619158744812 +elapsed time for k point: 0.303728103638 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.0716550350189 +elapsed time for k point: 0.283893823624 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.0770018100739 +elapsed time for k point: 0.231865882874 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0823910236359 +elapsed time for k point: 0.211749076843 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.0616590976715 +elapsed time for k point: 0.171858787537 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.0620040893555 +elapsed time for k point: 0.247880935669 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.0723211765289 +elapsed time for k point: 0.203945159912 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.23001909256 +.elapsed time for k point: 0.565998077393 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.280947953525 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.417114249325 at Vector3<0.5, 0.0, 0.0> to 0.546026779337 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.496197452765 at Vector3<0.5, 0.5, 0.0> to 0.557657636298 at Vector3<0.5, 0.0, 0.0> @@ -10071,9 +10152,9 @@ Band 8 range: 0.879351095829 at Vector3<0.5, 0.5, 0.0> to 1.08259238415 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.280947953525) to band 2 (0.417114249325), 39.0126539564% Gap from band 4 (0.713395151642) to band 5 (0.741310965707), 3.83800050492% -total elapsed time for run: 1.48546695709 +total elapsed time for run: 4.66124391556 done -test_run_tm: 1.49s +test_run_tm: 4.66s test_set_eigenvectors ======================== @@ -10118,88 +10199,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00273394584656 +elapsed time for initialization: 0.00458693504333 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... 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: 0.206640958786 +elapsed time for k point: 0.44723200798 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.598590135574 +elapsed time for k point: 1.42768001556 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.132802009583 +elapsed time for k point: 0.375879049301 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.120754003525 +elapsed time for k point: 0.288396120071 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.140247106552 +elapsed time for k point: 0.339313983917 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.217142820358 +elapsed time for k point: 0.55969285965 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.167666912079 +elapsed time for k point: 0.470656871796 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.139791965485 +elapsed time for k point: 0.364438056946 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.120813131332 +elapsed time for k point: 0.356169939041 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.115816116333 +elapsed time for k point: 0.3400349617 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.114567995071 +elapsed time for k point: 0.307597875595 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0920300483704 +elapsed time for k point: 0.263922929764 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.107066869736 +elapsed time for k point: 0.288151979446 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.144806861877 +elapsed time for k point: 0.447408914566 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.174566030502 +elapsed time for k point: 0.427716016769 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.364307165146 +elapsed time for k point: 0.847960948944 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -10211,7 +10292,7 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 2.96196389198 +total elapsed time for run: 7.5601348877 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -10254,88 +10335,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00296902656555 +elapsed time for initialization: 0.0257289409637 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... 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: 0.224929094315 +elapsed time for k point: 0.505129098892 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.656040906906 +elapsed time for k point: 1.3720369339 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.145066022873 +elapsed time for k point: 0.308911085129 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.133466959 +elapsed time for k point: 0.314736843109 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.154434919357 +elapsed time for k point: 0.353851079941 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.238953828812 +elapsed time for k point: 0.57389998436 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.180368900299 +elapsed time for k point: 0.407874822617 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.154923915863 +elapsed time for k point: 0.324663162231 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.132754087448 +elapsed time for k point: 0.279958963394 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.126873016357 +elapsed time for k point: 0.276175022125 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.126773834229 +elapsed time for k point: 0.273054838181 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.101550102234 +elapsed time for k point: 0.217666864395 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.116042852402 +elapsed time for k point: 0.331869840622 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.157828092575 +elapsed time for k point: 0.357762813568 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.186122179031 +elapsed time for k point: 0.399274110794 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.401557207108 +elapsed time for k point: 0.789439916611 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -10347,7 +10428,7 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.24227809906 +total elapsed time for run: 7.11402487755 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -10390,88 +10471,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00281095504761 +elapsed time for initialization: 0.174510955811 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... 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: 0.206592082977 +elapsed time for k point: 0.42426109314 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.60558795929 +elapsed time for k point: 1.26125812531 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.132834911346 +elapsed time for k point: 0.351768016815 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.122173070908 +elapsed time for k point: 0.258869886398 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.14102602005 +elapsed time for k point: 0.336889028549 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.218760967255 +elapsed time for k point: 0.47185587883 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.165886163712 +elapsed time for k point: 0.35978603363 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.13911318779 +elapsed time for k point: 0.286234855652 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.120131969452 +elapsed time for k point: 0.329616069794 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.116055011749 +elapsed time for k point: 0.303766965866 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.116086006165 +elapsed time for k point: 0.331825017929 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0928909778595 +elapsed time for k point: 0.239706993103 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.108542919159 +elapsed time for k point: 0.255832195282 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.14706492424 +elapsed time for k point: 0.399827957153 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.170602083206 +elapsed time for k point: 0.467856884003 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.359856128693 +.elapsed time for k point: 0.723018169403 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -10483,9 +10564,9 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 2.96755504608 +total elapsed time for run: 6.97946190834 done -test_set_eigenvectors: 9.17s +test_set_eigenvectors: 21.66s test_sq_rods ======================== @@ -10530,88 +10611,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00259590148926 +elapsed time for initialization: 0.041543006897 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... 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: 0.178650140762 +elapsed time for k point: 0.453480005264 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.658071994781 +elapsed time for k point: 1.50774502754 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.136691093445 +elapsed time for k point: 0.415874004364 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.110960960388 +elapsed time for k point: 0.270766973495 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.134448051453 +elapsed time for k point: 0.384896993637 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.239473104477 +elapsed time for k point: 0.563856840134 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.165207862854 +elapsed time for k point: 0.451885938644 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.135763883591 +elapsed time for k point: 0.331594944 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.117089986801 +elapsed time for k point: 0.276098012924 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.115015029907 +elapsed time for k point: 0.272155046463 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.110003948212 +elapsed time for k point: 0.295646905899 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0917391777039 +elapsed time for k point: 0.222234010696 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.102461099625 +elapsed time for k point: 0.233448028564 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.132704019547 +elapsed time for k point: 0.307843923569 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.177752017975 +elapsed time for k point: 0.400135040283 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.330335855484 +elapsed time for k point: 0.739773035049 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.503605801522 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.444622913471 at Vector3<0.5, 0.0, 0.0> to 0.594344024552 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.594356639447 at Vector3<0.5, 0.5, 0.0> to 0.780842812191 at Vector3<0.0, 0.0, 0.0> @@ -10623,7 +10704,7 @@ Gap from band 2 (0.594344024552) to band 3 (0.594356639447), 0.00212246791054% Gap from band 4 (0.817389371954) to band 5 (0.830457382234), 1.58607106473% Gap from band 7 (1.09580214922) to band 8 (1.09741680959), 0.14724114588% -total elapsed time for run: 2.94060611725 +total elapsed time for run: 7.17157411575 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -10666,88 +10747,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00277900695801 +elapsed time for initialization: 0.0614171028137 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... 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: 0.153003931046 +elapsed time for k point: 0.337618112564 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.147520065308 +elapsed time for k point: 0.355710029602 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.0737059116364 +elapsed time for k point: 0.187912940979 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.0733120441437 +elapsed time for k point: 0.159862995148 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.0742859840393 +elapsed time for k point: 0.179884910583 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.0800809860229 +elapsed time for k point: 0.187871932983 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.0652439594269 +elapsed time for k point: 0.171980142593 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.0682008266449 +elapsed time for k point: 0.154659986496 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.0672740936279 +elapsed time for k point: 0.153043985367 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.0780198574066 +elapsed time for k point: 0.259887933731 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.0829520225525 +elapsed time for k point: 0.22771191597 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.0947511196136 +elapsed time for k point: 0.228487014771 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.0690040588379 +elapsed time for k point: 0.159267902374 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.0687868595123 +elapsed time for k point: 0.151989936829 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.0728261470795 +elapsed time for k point: 0.156208992004 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.258026838303 +.elapsed time for k point: 0.603494882584 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.28590577912 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.4206573384 at Vector3<0.5, 0.0, 0.0> to 0.550336075483 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.502983097837 at Vector3<0.5, 0.5, 0.0> to 0.567163287813 at Vector3<0.5, 0.0, 0.0> @@ -10758,9 +10839,9 @@ Band 8 range: 0.89299334956 at Vector3<0.5, 0.5, 0.0> to 1.08937768201 at Vector3<0.0, 0.0, 0.0> Gap from band 1 (0.28590577912) to band 2 (0.4206573384), 38.1428228955% Gap from band 4 (0.720091820456) to band 5 (0.747202991048), 3.69539514201% -total elapsed time for run: 1.5314040184 +total elapsed time for run: 3.73935008049 done -test_sq_rods: 4.47s +test_sq_rods: 10.93s test_strip ======================== @@ -10804,90 +10885,90 @@ 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: 0.0101499557495 +elapsed time for initialization: 0.0782270431519 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... 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: 0.420346975327 +elapsed time for k point: 0.988813877106 zparity:, 1, 0.991845764323, -0.999316577892, 0.926395271377, 0.734287985347 yparity:, 1, -0.999999994167, 0.999999994877, 0.999999317144, -0.99999034331 solve_kpoint (0.39,0,0): Solving for bands 1 to 4... 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: 0.304897069931 +elapsed time for k point: 0.699402809143 zparity:, 2, 0.84979762905, -0.856208311583, 0.613504714472, 0.704049364348 yparity:, 2, -0.999999978241, 0.999999790163, 1.00000586834, -0.999935345258 solve_kpoint (0.68,0,0): Solving for bands 1 to 4... 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: 0.337680101395 +elapsed time for k point: 0.791615962982 zparity:, 3, 0.643047109774, -0.513297056489, 0.7493332279, -0.517458139251 yparity:, 3, -1.00000924371, 0.999986730786, -0.999977348488, 0.999973952734 solve_kpoint (0.97,0,0): Solving for bands 1 to 4... 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: 0.287110090256 +elapsed time for k point: 0.711381912231 zparity:, 4, 0.950559945676, -0.795378249422, 0.290959329597, -0.25994001915 yparity:, 4, -0.999975648561, 0.99997341981, -0.999995157307, 1.00000240214 solve_kpoint (1.26,0,0): Solving for bands 1 to 4... 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: 0.53297495842 +elapsed time for k point: 1.20695400238 zparity:, 5, 0.989433203648, -0.941034559795, -0.905709752061, 0.125905116396 yparity:, 5, -0.999934195805, 0.999992049633, -0.999995714577, 1.00002144472 solve_kpoint (1.55,0,0): Solving for bands 1 to 4... 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: 0.300680875778 +elapsed time for k point: 0.66352891922 zparity:, 6, 0.995326739505, -0.973076667003, -0.986247911215, 0.787849662167 yparity:, 6, -0.999907911974, 0.999996472511, -1.00000037749, 1.00017628212 solve_kpoint (1.84,0,0): Solving for bands 1 to 4... 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: 0.326297998428 +elapsed time for k point: 0.740242004395 zparity:, 7, 0.99732410812, -0.984353627052, -0.992065694749, 0.943289222925 yparity:, 7, -0.999884349307, 0.999998717603, -1.00000422896, 1.00025129525 solve_kpoint (2.13,0,0): Solving for bands 1 to 4... 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: 1.11586594582 +elapsed time for k point: 2.45674705505 zparity:, 8, 0.99824862905, -0.989579122305, -0.994248025412, -0.985837439536 yparity:, 8, -0.99986336361, 1.00000027727, -1.00000949462, -0.999844607748 solve_kpoint (2.42,0,0): Solving for bands 1 to 4... 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: 0.227620124817 +elapsed time for k point: 0.522677898407 zparity:, 9, 0.998753086191, -0.992422557413, -0.995415920791, -0.990851025724 yparity:, 9, -0.999845914689, 1.00000151004, -1.00001600828, -0.999840967114 solve_kpoint (2.71,0,0): Solving for bands 1 to 4... 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: 0.167644023895 +elapsed time for k point: 0.407525062561 zparity:, 10, 0.999058451884, -0.99413850546, -0.996144476211, -0.993490974654 yparity:, 10, -0.999833271898, 1.00000252462, -1.00002309233, -0.999834812139 solve_kpoint (3,0,0): Solving for bands 1 to 4... Finished solving for bands 1 to 4 after 16 iterations. freqs:, 11, 3, 0, 0, 3, 1.0815, 1.10429, 1.27693, 1.35105 -elapsed time for k point: 0.168747901917 +elapsed time for k point: 0.419481992722 zparity:, 11, 0.999257350936, -0.995250798058, -0.996639608967, -0.995090516581 yparity:, 11, -0.999826481415, 1.0000033584, -1.00003015737, -0.999833155067 Band 1 range: 0.0807582053405 at Vector3<0.1, 0.0, 0.0> to 1.08149969321 at Vector3<3.0, 0.0, 0.0> Band 2 range: 0.0855765355013 at Vector3<0.1, 0.0, 0.0> to 1.10428530979 at Vector3<3.0, 0.0, 0.0> Band 3 range: 0.314699680033 at Vector3<0.1, 0.0, 0.0> to 1.27692880877 at Vector3<3.0, 0.0, 0.0> Band 4 range: 0.394674794346 at Vector3<0.1, 0.0, 0.0> to 1.35104977582 at Vector3<3.0, 0.0, 0.0> -total elapsed time for run: 4.20260500908 +total elapsed time for run: 9.69195199013 done Initializing fields to random numbers... Initializing eigensolver data @@ -10920,14 +11001,14 @@ Initializing fields to random numbers... 1 k-points Vector3<2.22580645161, 0.0, 0.0> -elapsed time for initialization: 0.0107638835907 +elapsed time for initialization: 0.0314249992371 solve_kpoint (2.22581,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3, band 4 Solving for bands 1 to 4... Finished solving for bands 1 to 4 after 53 iterations. freqs:, 1, 2.22581, 0, 0, 2.22581, 0.897189, 0.92391, 1.0992, 1.20025 -elapsed time for k point: 0.54381108284 -total elapsed time for run: 0.554702997208 +elapsed time for k point: 1.20237898827 +total elapsed time for run: 1.23393106461 done find-k 4 at 2.22580645161: 0.555084522615 Initializing eigensolver data @@ -10960,14 +11041,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.0645161290323, 0.0, 0.0> -elapsed time for initialization: 0.0105531215668 +elapsed time for initialization: 0.0314970016479 solve_kpoint (0.0645161,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3, band 4 Solving for bands 1 to 4... Finished solving for bands 1 to 4 after 43 iterations. freqs:, 1, 0.0645161, 0, 0, 0.0645161, 0.05217, 0.055309, 0.308728, 0.391146 -elapsed time for k point: 0.442056179047 -total elapsed time for run: 0.452717065811 +elapsed time for k point: 0.970603942871 +total elapsed time for run: 1.00222015381 done find-k 4 at 0.0645161290323: -0.2540155697 Initializing eigensolver data @@ -11000,14 +11081,14 @@ Initializing fields to random numbers... 1 k-points Vector3<2.58064516129, 0.0, 0.0> -elapsed time for initialization: 0.0102832317352 +elapsed time for initialization: 0.0394761562347 solve_kpoint (2.58065,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3, band 4 Solving for bands 1 to 4... Finished solving for bands 1 to 4 after 46 iterations. freqs:, 1, 2.58065, 0, 0, 2.58065, 0.979885, 1.00486, 1.17985, 1.26669 -elapsed time for k point: 0.470345973969 -total elapsed time for run: 0.480744838715 +elapsed time for k point: 1.08121013641 +total elapsed time for run: 1.12086987495 done find-k 4 at 2.58064516129: 0.621532505066 Initializing eigensolver data @@ -11040,14 +11121,14 @@ Initializing fields to random numbers... 1 k-points Vector3<1.32258064516, 0.0, 0.0> -elapsed time for initialization: 0.0102939605713 +elapsed time for initialization: 0.0426440238953 solve_kpoint (1.32258,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3, band 4 Solving for bands 1 to 4... Finished solving for bands 1 to 4 after 67 iterations. freqs:, 1, 1.32258, 0, 0, 1.32258, 0.70442, 0.730073, 0.895938, 0.950718 -elapsed time for k point: 0.6819460392 -total elapsed time for run: 0.692336082458 +elapsed time for k point: 1.51675891876 +total elapsed time for run: 1.55953216553 done find-k 4 at 1.32258064516: 0.305556312378 Initializing eigensolver data @@ -11080,14 +11161,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.764214546724, 0.0, 0.0> -elapsed time for initialization: 0.0103640556335 +elapsed time for initialization: 0.0681648254395 solve_kpoint (0.764215,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3, band 4 Solving for bands 1 to 4... Finished solving for bands 1 to 4 after 41 iterations. freqs:, 1, 0.764215, 0, 0, 0.764215, 0.556038, 0.558219, 0.612015, 0.633507 -elapsed time for k point: 0.41983795166 -total elapsed time for run: 0.430299043655 +elapsed time for k point: 0.996015071869 +total elapsed time for run: 1.0643761158 done find-k 4 at 0.764214546724: -0.0116546538791 Initializing eigensolver data @@ -11120,14 +11201,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.789000236677, 0.0, 0.0> -elapsed time for initialization: 0.0104029178619 +elapsed time for initialization: 0.187935113907 solve_kpoint (0.789,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3, band 4 Solving for bands 1 to 4... Finished solving for bands 1 to 4 after 41 iterations. freqs:, 1, 0.789, 0, 0, 0.789, 0.56861, 0.570789, 0.622618, 0.645257 -elapsed time for k point: 0.422188997269 -total elapsed time for run: 0.432690858841 +elapsed time for k point: 0.991743087769 +total elapsed time for run: 1.17987203598 done find-k 4 at 0.789000236677: 9.52760957004e-05 find-k 3 at 0.789000236677: -0.0225429396409 (cached) @@ -11163,14 +11244,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.839636493413, 0.0, 0.0> -elapsed time for initialization: 0.00987601280212 +elapsed time for initialization: 0.0305581092834 solve_kpoint (0.839636,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3 Solving for bands 1 to 3... Finished solving for bands 1 to 3 after 39 iterations. freqs:, 1, 0.839636, 0, 0, 0.839636, 0.590583, 0.594418, 0.647157 -elapsed time for k point: 0.300535917282 -total elapsed time for run: 0.310505867004 +elapsed time for k point: 0.716969966888 +total elapsed time for run: 0.747807025909 done find-k 3 at 0.839636493413: 0.00199552624971 Initializing eigensolver data @@ -11203,14 +11284,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.835826416059, 0.0, 0.0> -elapsed time for initialization: 0.00983500480652 +elapsed time for initialization: 0.0689480304718 solve_kpoint (0.835826,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3 Solving for bands 1 to 3... Finished solving for bands 1 to 3 after 39 iterations. freqs:, 1, 0.835826, 0, 0, 0.835826, 0.589103, 0.59274, 0.645172 -elapsed time for k point: 0.263611078262 -total elapsed time for run: 0.273542881012 +elapsed time for k point: 0.616396903992 +total elapsed time for run: 0.685520887375 done find-k 3 at 0.835826416059: 1.06975429082e-05 find-k 2 at 0.835826416059: -0.0524213315718 (cached) @@ -11246,14 +11327,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.95425987465, 0.0, 0.0> -elapsed time for initialization: 0.00956320762634 +elapsed time for initialization: 0.043319940567 solve_kpoint (0.95426,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2 Solving for bands 1 to 2... Finished solving for bands 1 to 2 after 30 iterations. freqs:, 1, 0.95426, 0, 0, 0.95426, 0.62585, 0.637763 -elapsed time for k point: 0.152256965637 -total elapsed time for run: 0.161909103394 +elapsed time for k point: 0.374293804169 +total elapsed time for run: 0.417824029922 done find-k 2 at 0.95425987465: -0.00739874518833 Initializing eigensolver data @@ -11286,14 +11367,14 @@ Initializing fields to random numbers... 1 k-points Vector3<0.977006296664, 0.0, 0.0> -elapsed time for initialization: 0.00960111618042 +elapsed time for initialization: 0.193765878677 solve_kpoint (0.977006,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2 Solving for bands 1 to 2... Finished solving for bands 1 to 2 after 29 iterations. freqs:, 1, 0.977006, 0, 0, 0.977006, 0.631507, 0.644971 -elapsed time for k point: 0.124418973923 -total elapsed time for run: 0.134110927582 +elapsed time for k point: 0.397827863693 +total elapsed time for run: 0.591812133789 done find-k 2 at 0.977006296664: -0.000190225577968 find-k 1 at 2.22580645161: 0.252027371793 (cached) @@ -11329,14 +11410,14 @@ Initializing fields to random numbers... 1 k-points Vector3<1.1208817714, 0.0, 0.0> -elapsed time for initialization: 0.00918197631836 +elapsed time for initialization: 0.181108236313 solve_kpoint (1.12088,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1 Solving for bands 1 to 1... Finished solving for bands 1 to 1 after 31 iterations. freqs:, 1, 1.12088, 0, 0, 1.12088, 0.663439 -elapsed time for k point: 0.0636990070343 -total elapsed time for run: 0.072979927063 +elapsed time for k point: 0.242830038071 +total elapsed time for run: 0.424135923386 done find-k 1 at 1.1208817714: 0.0182778920892 Initializing eigensolver data @@ -11369,14 +11450,14 @@ Initializing fields to random numbers... 1 k-points Vector3<1.03334852826, 0.0, 0.0> -elapsed time for initialization: 0.00946021080017 +elapsed time for initialization: 0.156795024872 solve_kpoint (1.03335,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1 Solving for bands 1 to 1... Finished solving for bands 1 to 1 after 33 iterations. freqs:, 1, 1.03335, 0, 0, 1.03335, 0.644604 -elapsed time for k point: 0.084184885025 -total elapsed time for run: 0.0937390327454 +elapsed time for k point: 0.204818964005 +total elapsed time for run: 0.36180305481 done find-k 1 at 1.03334852826: -0.000557634136477 Initializing eigensolver data @@ -11409,14 +11490,14 @@ Initializing fields to random numbers... 1 k-points Vector3<1.03584152004, 0.0, 0.0> -elapsed time for initialization: 0.00904417037964 +elapsed time for initialization: 0.0782990455627 solve_kpoint (1.03584,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1 Solving for bands 1 to 1... Finished solving for bands 1 to 1 after 33 iterations. freqs:, 1, 1.03584, 0, 0, 1.03584, 0.645161 -elapsed time for k point: 0.0679008960724 -total elapsed time for run: 0.0770270824432 +elapsed time for k point: 0.215658187866 +total elapsed time for run: 0.294095039368 done find-k 1 at 1.03584152004: -7.8424049943e-07 Initializing eigensolver data @@ -11449,17 +11530,17 @@ Initializing fields to random numbers... 1 k-points Vector3<1.03584503596, 0.0, 0.0> -elapsed time for initialization: 0.00992584228516 +elapsed time for initialization: 0.0265710353851 solve_kpoint (1.03585,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3, band 4 Solving for bands 1 to 4... Finished solving for bands 1 to 4 after 42 iterations. freqs:, 1, 1.03585, 0, 0, 1.03585, 0.645161, 0.662112, 0.765915, 0.77985 -elapsed time for k point: 0.420429944992 +elapsed time for k point: 1.03224301338 Outputting fields to test_strip-flux.v.k01.b04.x.h5... yparity:, 1, -0.999961745053, 0.999981352697, -0.999996484397, 1.00000240523 velocity:, 1, Vector3<0.223053364007, -1.65971417968e-05, -4.43949578197e-07>, Vector3<0.275781519108, -2.29679618747e-08, 2.48574079393e-06>, Vector3<0.640344418656, -8.89447683809e-07, 2.70294082095e-08>, Vector3<0.598378122761, 6.7988323807e-07, 7.00490024892e-07> -total elapsed time for run: 0.514719963074 +total elapsed time for run: 1.26199698448 done Initializing eigensolver data Computing 3 bands with 1e-12 tolerance @@ -11491,17 +11572,17 @@ Initializing fields to random numbers... 1 k-points Vector3<0.977622101449, 0.0, 0.0> -elapsed time for initialization: 0.00994896888733 +elapsed time for initialization: 0.0440919399261 solve_kpoint (0.977622,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2, band 3 Solving for bands 1 to 3... Finished solving for bands 1 to 3 after 42 iterations. freqs:, 1, 0.977622, 0, 0, 0.977622, 0.631657, 0.645161, 0.728827 -elapsed time for k point: 0.318868875504 +elapsed time for k point: 0.792705059052 Outputting fields to test_strip-flux.v.k01.b03.x.h5... yparity:, 1, -0.999973901721, 0.99997467296, -0.999995585369 velocity:, 1, Vector3<0.242791049683, -1.51042977422e-05, -4.45845754135e-07>, Vector3<0.308492291467, -2.80824727221e-07, 2.21219664617e-06>, Vector3<0.631455897551, -1.15170016184e-06, -2.49206516784e-08> -total elapsed time for run: 0.411325931549 +total elapsed time for run: 1.05071187019 done Initializing eigensolver data Computing 2 bands with 1e-12 tolerance @@ -11533,17 +11614,17 @@ Initializing fields to random numbers... 1 k-points Vector3<0.835805768998, 0.0, 0.0> -elapsed time for initialization: 0.00940585136414 +elapsed time for initialization: 0.0447390079498 solve_kpoint (0.835806,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1, band 2 Solving for bands 1 to 2... Finished solving for bands 1 to 2 after 32 iterations. freqs:, 1, 0.835806, 0, 0, 0.835806, 0.589095, 0.592731 -elapsed time for k point: 0.134715080261 +elapsed time for k point: 0.3974609375 Outputting fields to test_strip-flux.v.k01.b02.x.h5... yparity:, 1, -1.00004875683, 0.999921187908 velocity:, 1, Vector3<0.392057598297, -1.00894909208e-05, -2.19745357392e-07>, Vector3<0.442646171777, 3.82711138544e-07, 1.06153249621e-06> -total elapsed time for run: 0.224824905396 +total elapsed time for run: 0.81987118721 done Initializing eigensolver data Computing 1 bands with 1e-12 tolerance @@ -11575,20 +11656,20 @@ Initializing fields to random numbers... 1 k-points Vector3<0.788801145908, 0.0, 0.0> -elapsed time for initialization: 0.00935411453247 +elapsed time for initialization: 0.0239260196686 solve_kpoint (0.788801,0,0): freqs:, k index, k1, k2, k3, kmag/2pi, band 1 Solving for bands 1 to 1... Finished solving for bands 1 to 1 after 56 iterations. freqs:, 1, 0.788801, 0, 0, 0.788801, 0.568514 -.elapsed time for k point: 0.139786958694 +.elapsed time for k point: 0.293136835098 Outputting fields to test_strip-flux.v.k01.b01.x.h5... yparity:, 1, -1.00007453249 velocity:, 1, Vector3<0.484362020207, -1.00840712819e-05, -1.43904023173e-07> -total elapsed time for run: 0.229068040848 +total elapsed time for run: 0.480976104736 done kvals:, 0.645161290323, 1, 4, 0.0, 0.0, 0.0, 1.0, 0.0, 0.0, 1.03584503596, 0.977622101449, 0.835805768998, 0.788801145908 -test_strip: 9.77s +test_strip: 24.10s test_subpixel_averaging ======================== @@ -11633,88 +11714,88 @@ Vector3<0.2, 0.2, 0.0> Vector3<0.1, 0.1, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00267291069031 +elapsed time for initialization: 0.00982785224915 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... 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: 0.228585004807 +elapsed time for k point: 0.448827028275 solve_kpoint (0.1,0,0): Solving for bands 1 to 8... 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: 0.661395072937 +elapsed time for k point: 1.38755822182 solve_kpoint (0.2,0,0): Solving for bands 1 to 8... 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: 0.142488956451 +elapsed time for k point: 0.391831159592 solve_kpoint (0.3,0,0): Solving for bands 1 to 8... 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: 0.132804870605 +elapsed time for k point: 0.33581495285 solve_kpoint (0.4,0,0): Solving for bands 1 to 8... 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: 0.153469085693 +elapsed time for k point: 0.415711164474 solve_kpoint (0.5,0,0): Solving for bands 1 to 8... 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: 0.241943120956 +elapsed time for k point: 0.523687124252 solve_kpoint (0.5,0.1,0): Solving for bands 1 to 8... 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: 0.181606054306 +elapsed time for k point: 0.456008911133 solve_kpoint (0.5,0.2,0): Solving for bands 1 to 8... 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: 0.154938936234 +elapsed time for k point: 0.42377781868 solve_kpoint (0.5,0.3,0): Solving for bands 1 to 8... 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: 0.131749153137 +elapsed time for k point: 0.307831048965 solve_kpoint (0.5,0.4,0): Solving for bands 1 to 8... 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: 0.128441095352 +elapsed time for k point: 0.355782032013 solve_kpoint (0.5,0.5,0): Solving for bands 1 to 8... 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: 0.127746105194 +elapsed time for k point: 0.323853969574 solve_kpoint (0.4,0.4,0): Solving for bands 1 to 8... 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: 0.10063290596 +elapsed time for k point: 0.30770111084 solve_kpoint (0.3,0.3,0): Solving for bands 1 to 8... 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: 0.117974996567 +elapsed time for k point: 0.324283838272 solve_kpoint (0.2,0.2,0): Solving for bands 1 to 8... 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: 0.160185098648 +elapsed time for k point: 0.419401884079 solve_kpoint (0.1,0.1,0): Solving for bands 1 to 8... 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: 0.186378955841 +elapsed time for k point: 0.409411907196 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.401036024094 +elapsed time for k point: 0.858319997787 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.496835864745 at Vector3<0.5, 0.5, 0.0> Band 2 range: 0.441588449723 at Vector3<0.5, 0.0, 0.0> to 0.593140514116 at Vector3<0.5, 0.5, 0.0> Band 3 range: 0.593153586312 at Vector3<0.5, 0.5, 0.0> to 0.773226559307 at Vector3<0.0, 0.0, 0.0> @@ -11726,11 +11807,11 @@ Gap from band 2 (0.593140514116) to band 3 (0.593153586312), 0.00220387097765% Gap from band 4 (0.809689155168) to band 5 (0.82418144435), 1.77398249124% Gap from band 7 (1.08607293236) to band 8 (1.08786896351), 0.165232672434% -total elapsed time for run: 3.25564408302 +total elapsed time for run: 7.70291686058 done epsilon: 1-12, mean 2.38229, harm. mean 1.1448, 14.5508% > 1, 12.5663% "fill" .Outputting test_subpixel_averaging-epsilon.h5... -test_subpixel_averaging: 3.27s +test_subpixel_averaging: 8.06s test_tri_holes ======================== @@ -11775,88 +11856,88 @@ Vector3<-0.133333333333, 0.133333333333, 0.0> Vector3<-0.0666666666667, 0.0666666666667, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0049991607666 +elapsed time for initialization: 0.0174539089203 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... 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: 0.241515874863 +elapsed time for k point: 0.487325906754 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... 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: 0.277542829514 +elapsed time for k point: 0.571300983429 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... 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: 0.15541601181 +elapsed time for k point: 0.356039047241 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... 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: 0.152988910675 +elapsed time for k point: 0.407804965973 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... 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: 0.164345026016 +elapsed time for k point: 0.395958900452 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... 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: 0.190814971924 +elapsed time for k point: 0.439697980881 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... 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: 0.15488910675 +elapsed time for k point: 0.351618051529 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... 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: 0.169516086578 +elapsed time for k point: 0.419954776764 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... 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: 0.168802022934 +elapsed time for k point: 0.415813922882 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... 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: 0.174071788788 +elapsed time for k point: 0.380638122559 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... 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: 0.292804002762 +elapsed time for k point: 0.679054021835 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... 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: 0.157392024994 +elapsed time for k point: 0.431855916977 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... 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: 0.147040128708 +elapsed time for k point: 0.313676834106 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... 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: 0.140313148499 +elapsed time for k point: 0.361954927444 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... 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: 0.172644853592 +elapsed time for k point: 0.439847946167 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.469465970993 +elapsed time for k point: 0.918813943863 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.299304947312 at Vector3<-0.333333333333, 0.333333333333, 0.0> Band 2 range: 0.492434282362 at Vector3<0.0, 0.5, 0.0> to 0.65683626835 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.526971050645 at Vector3<-0.333333333333, 0.333333333333, 0.0> to 0.715623220021 at Vector3<0.0, 0.0, 0.0> @@ -11868,7 +11949,7 @@ Gap from band 1 (0.299304947312) to band 2 (0.492434282362), 48.7860971926% Gap from band 5 (0.79881687928) to band 6 (0.82597871647), 3.34341590548% Gap from band 7 (0.983456330353) to band 8 (0.998420061184), 1.51005692332% -total elapsed time for run: 3.23622202873 +total elapsed time for run: 7.39153194427 done Initializing eigensolver data Computing 8 bands with 1e-12 tolerance @@ -11911,88 +11992,88 @@ Vector3<-0.133333333333, 0.133333333333, 0.0> Vector3<-0.0666666666667, 0.0666666666667, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0053870677948 +elapsed time for initialization: 0.0309998989105 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... 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: 0.125059127808 +elapsed time for k point: 0.357246160507 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... 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: 0.103186845779 +elapsed time for k point: 0.255876064301 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... 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: 0.0830249786377 +elapsed time for k point: 0.263720989227 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... 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: 0.0733828544617 +elapsed time for k point: 0.224179029465 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... 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: 0.0675799846649 +elapsed time for k point: 0.187562942505 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... 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: 0.0778729915619 +elapsed time for k point: 0.174302101135 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... 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: 0.0724110603333 +elapsed time for k point: 0.153915882111 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... 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: 0.0776011943817 +elapsed time for k point: 0.171361207962 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... 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: 0.0775518417358 +elapsed time for k point: 0.169903039932 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... 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: 0.0832560062408 +elapsed time for k point: 0.266003847122 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... 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: 0.136974096298 +elapsed time for k point: 0.399710893631 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... 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: 0.078784942627 +elapsed time for k point: 0.267873048782 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... 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: 0.0688309669495 +elapsed time for k point: 0.25177192688 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... 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: 0.0681278705597 +elapsed time for k point: 0.179795026779 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... 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: 0.0932059288025 +elapsed time for k point: 0.207857131958 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.123221874237 +.elapsed time for k point: 0.335921049118 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.280091568174 at Vector3<-0.333333333333, 0.333333333333, 0.0> Band 2 range: 0.280155239138 at Vector3<-0.333333333333, 0.333333333333, 0.0> to 0.398512608105 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.439081722845 at Vector3<-0.333333333333, 0.333333333333, 0.0> to 0.4928881019 at Vector3<0.0, 0.0, 0.0> @@ -12007,9 +12088,9 @@ Gap from band 4 (0.580870136527) to band 5 (0.581035246804), 0.0284206063456% Gap from band 5 (0.682486080137) to band 6 (0.682531744672), 0.0066906868718% Gap from band 7 (0.784104262239) to band 8 (0.798007787259), 1.75759043419% -total elapsed time for run: 1.41706299782 +total elapsed time for run: 3.90077996254 done -test_tri_holes: 4.65s +test_tri_holes: 11.30s test_tri_rods ======================== @@ -12054,63 +12135,63 @@ Vector3<-0.133333333333, 0.133333333333, 0.0> Vector3<-0.0666666666667, 0.0666666666667, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00304007530212 +elapsed time for initialization: 0.126420021057 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... 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: 0.096333026886 +elapsed time for k point: 0.217840909958 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... 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: 0.093003988266 +elapsed time for k point: 0.219343900681 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... 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: 0.079283952713 +elapsed time for k point: 0.183804988861 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... 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: 0.0737628936768 +elapsed time for k point: 0.164349079132 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... 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: 0.0682458877563 +elapsed time for k point: 0.148659229279 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... 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: 0.0702140331268 +elapsed time for k point: 0.178472042084 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... 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: 0.0628311634064 +elapsed time for k point: 0.175698041916 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... 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: 0.0633778572083 +elapsed time for k point: 0.227831840515 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... 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: 0.0532369613647 +elapsed time for k point: 0.215706825256 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... 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: 0.052402973175 +elapsed time for k point: 0.199802160263 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... 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: 0.0485608577728 +elapsed time for k point: 0.139590024948 Fixing e-field (band 1) phase by -1 + 4.11947e-08i; max ampl. = 0.93911 Outputting fields to test_tri_rods-e.k11.b01.z.tm.h5... Fixing e-field (band 2) phase by 4.11947e-08 + 1i; max ampl. = 1.08316 @@ -12131,27 +12212,27 @@ Solving for bands 1 to 8... 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: 0.0587780475616 +elapsed time for k point: 0.155035018921 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... 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: 0.0630011558533 +elapsed time for k point: 0.18373298645 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... 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: 0.0679621696472 +elapsed time for k point: 0.171725034714 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... 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: 0.0875449180603 +elapsed time for k point: 0.203814029694 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.0652248859406 +elapsed time for k point: 0.151937007904 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.274690225862 at Vector3<-0.333333333333, 0.333333333333, 0.0> Band 2 range: 0.445331080847 at Vector3<0.0, 0.5, 0.0> to 0.560518142316 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.490238914903 at Vector3<-0.333333333333, 0.333333333333, 0.0> to 0.56056079478 at Vector3<0.0, 0.0, 0.0> @@ -12165,7 +12246,7 @@ Gap from band 4 (0.790719597444) to band 5 (0.790832076333), 0.0142238651133% Gap from band 5 (0.837451116754) to band 6 (0.837594852844), 0.0171620472727% Gap from band 6 (0.86720092649) to band 7 (0.869134995574), 0.222775910928% -total elapsed time for run: 1.13160395622 +total elapsed time for run: 3.55629110336 done Read lattice vectors Read Bloch wavevector (-0.333333, 0.333333, 0) @@ -12216,88 +12297,88 @@ Vector3<-0.133333333333, 0.133333333333, 0.0> Vector3<-0.0666666666667, 0.0666666666667, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.00312900543213 +elapsed time for initialization: 0.0586321353912 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... 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: 0.220218896866 +elapsed time for k point: 0.455629110336 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... 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: 0.158370018005 +elapsed time for k point: 0.315556049347 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... 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: 0.147289991379 +elapsed time for k point: 0.306910991669 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... 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: 0.128077030182 +elapsed time for k point: 0.26323890686 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... 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: 0.11820101738 +elapsed time for k point: 0.244475841522 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... 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: 0.110858917236 +elapsed time for k point: 0.25417304039 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... 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: 0.122262001038 +elapsed time for k point: 0.321655988693 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... 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: 0.12508392334 +elapsed time for k point: 0.261151790619 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... 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: 0.118358850479 +elapsed time for k point: 0.306355953217 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... 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: 0.113274097443 +elapsed time for k point: 0.275872945786 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... 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: 0.0976948738098 +elapsed time for k point: 0.27174115181 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... 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: 0.107778072357 +elapsed time for k point: 0.263803005219 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... 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: 0.11327290535 +elapsed time for k point: 0.251739025116 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... 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: 0.136713981628 +elapsed time for k point: 0.282897949219 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... 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: 0.165139913559 +elapsed time for k point: 0.356904029846 solve_kpoint (0,0,0): Solving for bands 2 to 8... 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: 0.13866519928 +elapsed time for k point: 0.335686922073 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.491235811868 at Vector3<-0.333333333333, 0.333333333333, 0.0> Band 2 range: 0.473072239028 at Vector3<0.0, 0.5, 0.0> to 0.563105937871 at Vector3<-0.333333333333, 0.333333333333, 0.0> Band 3 range: 0.563150519856 at Vector3<-0.333333333333, 0.333333333333, 0.0> to 0.793928939584 at Vector3<0.0, 0.0, 0.0> @@ -12308,7 +12389,7 @@ Band 8 range: 1.10866265854 at Vector3<-0.266666666667, 0.266666666667, 0.0> to 1.11681071913 at Vector3<0.0, 0.0, 0.0> Gap from band 2 (0.563105937871) to band 3 (0.563150519856), 0.00791684419565% Gap from band 4 (0.821423004419) to band 5 (0.865194814442), 5.1904835266% -total elapsed time for run: 2.12609410286 +total elapsed time for run: 4.82947707176 done epsilon: 1-12, mean 2.59614, harm. mean 1.17149, 17.2852% > 1, 14.5104% "fill" .Read lattice vectors @@ -12318,7 +12399,7 @@ Input data is rank 2, size 32x32x1. Output data 96x83x1 real part range: 1 .. 12 -test_tri_rods: 3.28s +test_tri_rods: 8.44s test_triangular_lattice ======================== @@ -12363,83 +12444,83 @@ Vector3<-0.133333333333, 0.133333333333, 0.0> Vector3<-0.0666666666667, 0.0666666666667, 0.0> Vector3<0.0, 0.0, 0.0> -elapsed time for initialization: 0.0030210018158 +elapsed time for initialization: 0.0527918338776 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... 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: 0.108202934265 +elapsed time for k point: 0.217872858047 solve_kpoint (0,0.1,0): Solving for bands 1 to 8... 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: 0.101739168167 +elapsed time for k point: 0.211589813232 solve_kpoint (0,0.2,0): Solving for bands 1 to 8... 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: 0.0846638679504 +elapsed time for k point: 0.177405834198 solve_kpoint (0,0.3,0): Solving for bands 1 to 8... 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: 0.0791130065918 +elapsed time for k point: 0.166213989258 solve_kpoint (0,0.4,0): Solving for bands 1 to 8... 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: 0.0742528438568 +elapsed time for k point: 0.171879053116 solve_kpoint (0,0.5,0): Solving for bands 1 to 8... 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: 0.0742499828339 +elapsed time for k point: 0.167960166931 solve_kpoint (-0.0666667,0.466667,0): Solving for bands 1 to 8... 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: 0.0681130886078 +elapsed time for k point: 0.151224136353 solve_kpoint (-0.133333,0.433333,0): Solving for bands 1 to 8... 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: 0.0683751106262 +elapsed time for k point: 0.228335142136 solve_kpoint (-0.2,0.4,0): Solving for bands 1 to 8... 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: 0.0583920478821 +elapsed time for k point: 0.215877056122 solve_kpoint (-0.266667,0.366667,0): Solving for bands 1 to 8... 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: 0.0576908588409 +elapsed time for k point: 0.228471040726 solve_kpoint (-0.333333,0.333333,0): Solving for bands 1 to 8... 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: 0.0527060031891 +elapsed time for k point: 0.151888132095 solve_kpoint (-0.266667,0.266667,0): Solving for bands 1 to 8... 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: 0.0636448860168 +elapsed time for k point: 0.211824178696 solve_kpoint (-0.2,0.2,0): Solving for bands 1 to 8... 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: 0.0689299106598 +elapsed time for k point: 0.180011034012 solve_kpoint (-0.133333,0.133333,0): Solving for bands 1 to 8... 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: 0.0747089385986 +elapsed time for k point: 0.223688840866 solve_kpoint (-0.0666667,0.0666667,0): Solving for bands 1 to 8... 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: 0.0966589450836 +elapsed time for k point: 0.307762145996 solve_kpoint (0,0,0): Solving for bands 2 to 8... Finished solving for bands 2 to 8 after 16 iterations. @@ -12458,10 +12539,10 @@ AssertionError: 0.003278687633016472 not less than 0.001 ---------------------------------------------------------------------- -Ran 45 tests in 331.057s +Ran 45 tests in 764.872s FAILED (failures=1) -elapsed time for k point: 0.0725109577179 +elapsed time for k point: 0.168757915497 Band 1 range: 0.0 at Vector3<0.0, 0.0, 0.0> to 0.274690225862 at Vector3<-0.333333333333, 0.333333333333, 0.0> Band 2 range: 0.445331080847 at Vector3<0.0, 0.5, 0.0> to 0.560518142316 at Vector3<0.0, 0.0, 0.0> Band 3 range: 0.490238914903 at Vector3<-0.333333333333, 0.333333333333, 0.0> to 0.56056079478 at Vector3<0.0, 0.0, 0.0> @@ -12475,159 +12556,17 @@ Gap from band 4 (0.790719597444) to band 5 (0.790832076333), 0.0142238651133% Gap from band 5 (0.837451116754) to band 6 (0.837594852844), 0.0171620472726% Gap from band 6 (0.86720092649) to band 7 (0.869134995574), 0.222775910928% -total elapsed time for run: 1.20856904984 +total elapsed time for run: 3.23949408531 done -test_triangular_lattice: 1.21s +test_triangular_lattice: 3.24s test_update_band_range_data ======================== test_update_band_range_data: 0.00s -Elapsed run time = 331.0722 s +Elapsed run time = 765.0540 s FAIL tests/mpb.py (exit status: 1) -FAIL: tests/mode_coeffs -======================= - ------------ -Initializing structure... -Padding y to even number of grid points. -Halving computational cell along direction y -Working in 2D dimensions. -Computational cell is 16 x 13 x 0 with resolution 15 - prism, center = (0,0,5e+19) - height 1e+20, axis (0,0,1), 4 vertices: - (-17,0.5,0) - (17,0.5,0) - (17,-0.5,0) - (-17,-0.5,0) - dielectric constant epsilon diagonal = (12,12,12) -time for set_epsilon = 0.09147 s ------------ -MPB solved for omega_1(0.69282,0,0) = 0.225038 after 24 iters -MPB solved for omega_1(0.602175,0,0) = 0.200015 after 8 iters -MPB solved for omega_1(0.602119,0,0) = 0.2 after 4 iters -run 0 finished at t = 200.0 (6000 timesteps) -MPB solved for omega_1(0.69282,0,0) = 0.224431 after 29 iters -MPB solved for omega_1(0.604363,0,0) = 0.200017 after 10 iters -MPB solved for omega_1(0.604301,0,0) = 0.2 after 4 iters -MPB solved for omega_1(0.604301,0,0) = 0.2 after 1 iters -Dominant planewave for band 1: (0.604301,-0.000000,0.000000) -MPB solved for omega_2(0.69282,0,0) = 0.246347 after 25 iters -MPB solved for omega_2(0.499945,0,0) = 0.201915 after 13 iters -MPB solved for omega_2(0.491208,0,0) = 0.200005 after 8 iters -MPB solved for omega_2(0.491186,0,0) = 0.2 after 4 iters -MPB solved for omega_2(0.491186,0,0) = 0.2 after 1 iters -Dominant planewave for band 2: (0.491186,-0.000000,0.000000) -.----------- -Initializing structure... -Padding y to even number of grid points. -Halving computational cell along direction y -Working in 2D dimensions. -Computational cell is 16 x 13 x 0 with resolution 15 - prism, center = (0,0,5e+19) - height 1e+20, axis (0,0,1), 4 vertices: - (-17,0.5,0) - (17,0.5,0) - (17,-0.5,0) - (-17,-0.5,0) - dielectric constant epsilon diagonal = (12,12,12) -time for set_epsilon = 0.0964399 s ------------ -MPB solved for omega_1(0.69282,0,0) = 0.225038 after 21 iters -MPB solved for omega_1(0.602175,0,0) = 0.200015 after 8 iters -MPB solved for omega_1(0.602119,0,0) = 0.2 after 4 iters -run 0 finished at t = 200.0 (6000 timesteps) -MPB solved for omega_1(0.69282,0,0) = 0.224431 after 27 iters -MPB solved for omega_1(0.604363,0,0) = 0.200017 after 10 iters -MPB solved for omega_1(0.604301,0,0) = 0.2 after 4 iters -MPB solved for omega_1(0.604301,0,0) = 0.2 after 1 iters -Dominant planewave for band 1: (0.604301,-0.000000,0.000000) -MPB solved for omega_2(0.69282,0,0) = 0.246347 after 24 iters -MPB solved for omega_2(0.499945,0,0) = 0.201915 after 13 iters -MPB solved for omega_2(0.491208,0,0) = 0.200005 after 8 iters -MPB solved for omega_2(0.491186,0,0) = 0.2 after 4 iters -MPB solved for omega_2(0.491186,0,0) = 0.2 after 1 iters -Dominant planewave for band 2: (0.491186,-0.000000,0.000000) ------------ -Initializing structure... -Padding y to even number of grid points. -Halving computational cell along direction y -Working in 2D dimensions. -Computational cell is 16 x 13 x 0 with resolution 15 - prism, center = (0,0,5e+19) - height 1e+20, axis (0,0,1), 4 vertices: - (-17,0.5,0) - (17,0.5,0) - (17,-0.5,0) - (-17,-0.5,0) - dielectric constant epsilon diagonal = (12,12,12) -time for set_epsilon = 0.094696 s ------------ -MPB solved for omega_2(0.69282,0,0) = 0.246921 after 22 iters -MPB solved for omega_2(0.497128,0,0) = 0.201968 after 10 iters -MPB solved for omega_2(0.488118,0,0) = 0.200005 after 8 iters -MPB solved for omega_2(0.488095,0,0) = 0.2 after 4 iters -MPB solved for omega_2(0.488095,0,0) = 0.2 after 1 iters -run 0 finished at t = 200.0 (6000 timesteps) -MPB solved for omega_1(0.69282,0,0) = 0.224431 after 26 iters -MPB solved for omega_1(0.604363,0,0) = 0.200017 after 10 iters -MPB solved for omega_1(0.604301,0,0) = 0.2 after 4 iters -MPB solved for omega_1(0.604301,0,0) = 0.2 after 1 iters -Dominant planewave for band 1: (0.604301,-0.000000,0.000000) -MPB solved for omega_2(0.69282,0,0) = 0.246347 after 29 iters -MPB solved for omega_2(0.499945,0,0) = 0.201915 after 13 iters -MPB solved for omega_2(0.491208,0,0) = 0.200005 after 8 iters -MPB solved for omega_2(0.491186,0,0) = 0.2 after 4 iters -MPB solved for omega_2(0.491186,0,0) = 0.2 after 1 iters -Dominant planewave for band 2: (0.491186,-0.000000,0.000000) -MPB solved for omega_2(0.69282,0,0) = 0.246347 after 25 iters -MPB solved for omega_2(0.499945,0,0) = 0.201915 after 13 iters -MPB solved for omega_2(0.491208,0,0) = 0.200005 after 8 iters -MPB solved for omega_2(0.491186,0,0) = 0.2 after 4 iters -MPB solved for omega_2(0.491186,0,0) = 0.2 after 1 iters -Dominant planewave for band 2: (0.491186,-0.000000,0.000000) -F -====================================================================== -FAIL: test_modes (__main__.TestModeCoeffs) ----------------------------------------------------------------------- -Traceback (most recent call last): - File "./tests/mode_coeffs.py", line 104, in test_modes - self.assertAlmostEqual(ex_at_eval_point, 0.10591314723115094+0.12458333138964374j, places=2) -AssertionError: 0j != (0.10591314723115094+0.12458333138964374j) within 2 places - ----------------------------------------------------------------------- -Ran 2 tests in 10.975s - -FAILED (failures=1) - -Elapsed run time = 10.9755 s - -Field time usage: - connecting chunks: 0.0265018 s - time stepping: 3.14446 s - communicating: 0.197654 s - Fourier transforming: 0.118895 s - everything else: 0.0510482 s - - -Field time usage: - connecting chunks: 0.0254802 s - time stepping: 3.14182 s - communicating: 0.192255 s - Fourier transforming: 0.117575 s - everything else: 0.0629857 s - - -Field time usage: - connecting chunks: 0.0247969 s - time stepping: 3.09818 s - communicating: 0.193761 s - Fourier transforming: 0.117576 s - everything else: 0.0558215 s - -FAIL tests/mode_coeffs.py (exit status: 1) - FAIL: tests/multilevel_atom =========================== @@ -12639,20 +12578,28 @@ 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 = 0.000116101 s +time for set_epsilon = 0.000397934 s multilevel atom susceptibility ----------- -Meep progress: 3063.1125/7000.0 = 43.8% done in 4.0s, 5.1s to go -on time step 245049 (time=3063.11), 1.63235e-05 s/step -Meep progress: 6078.525/7000.0 = 86.8% done in 8.0s, 1.2s to go -on time step 486288 (time=6078.6), 1.65811e-05 s/step +Meep progress: 1131.925/7000.0 = 16.2% done in 4.0s, 20.7s to go +on time step 90554 (time=1131.92), 4.4173e-05 s/step +Meep progress: 2285.8/7000.0 = 32.7% done in 8.0s, 16.5s to go +on time step 182865 (time=2285.81), 4.33322e-05 s/step +Meep progress: 3428.5875/7000.0 = 49.0% done in 12.0s, 12.5s to go +on time step 274289 (time=3428.61), 4.37524e-05 s/step +Meep progress: 4559.4875/7000.0 = 65.1% done in 16.0s, 8.6s to go +on time step 364762 (time=4559.53), 4.42121e-05 s/step +Meep progress: 5701.175/7000.0 = 81.4% done in 20.0s, 4.6s to go +on time step 456098 (time=5701.23), 4.37946e-05 s/step +Meep progress: 6837.8375/7000.0 = 97.7% done in 24.0s, 0.6s to go +on time step 547032 (time=6837.9), 4.39883e-05 s/step F Field time usage: - connecting chunks: 0.000107023 s - time stepping: 6.6558 s - communicating: 0.508408 s - Fourier transforming: 0.0350121 s - everything else: 2.01881 s + connecting chunks: 0.000326058 s + time stepping: 15.4465 s + communicating: 3.43249 s + Fourier transforming: 0.365995 s + everything else: 5.31468 s ====================================================================== @@ -12676,11 +12623,11 @@ AssertionError: 1.5971802034720794e-06 != -2.7110969214986387 within 7 places ---------------------------------------------------------------------- -Ran 1 test in 9.219s +Ran 1 test in 24.565s FAILED (failures=1) -Elapsed run time = 9.2198 s +Elapsed run time = 24.5975 s FAIL tests/multilevel_atom.py (exit status: 1) FAIL: tests/ring @@ -12697,7 +12644,7 @@ 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 = 0.0739 s +time for set_epsilon = 0.11095 s ----------- creating output file "./ring-eps-000000.00.h5"... F @@ -12710,7 +12657,7 @@ AssertionError: 0.003494201718963652 != 0.00341267634436 within 4 places ---------------------------------------------------------------------- -Ran 1 test in 1.417s +Ran 1 test in 4.114s FAILED (failures=1) harminv0:, frequency, imag. freq., Q, |amp|, amplitude, error @@ -12719,15 +12666,15 @@ harminv0:, 0.175246234736, -4.94040800947e-05, 1773.60082811, 0.00719137958882, -0.000821490549216-0.00714430498146i, 7.74302741921e-08+0.0i run 0 finished at t = 400.0 (8000 timesteps) -Elapsed run time = 1.4171 s +Elapsed run time = 4.1149 s Field time usage: - connecting chunks: 0.00829495 s - time stepping: 0.999201 s - communicating: 0.101651 s - outputting fields: 0.00462391 s - Fourier transforming: 0.00104483 s - everything else: 0.152561 s + connecting chunks: 0.0194712 s + time stepping: 1.98837 s + communicating: 0.229628 s + outputting fields: 1.36635 s + Fourier transforming: 0.00598518 s + everything else: 0.269174 s FAIL tests/ring.py (exit status: 1) @@ -12741,16 +12688,16 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.0266269 s +time for set_epsilon = 0.047988 s ----------- run 0 finished at t = 12.0 (480 timesteps) Field time usage: - connecting chunks: 0.00713198 s - time stepping: 0.0402603 s - communicating: 0.00362903 s - Fourier transforming: 3.34884e-05 s - everything else: 0.0043464 s + connecting chunks: 0.0115471 s + time stepping: 0.0951244 s + communicating: 0.0110912 s + Fourier transforming: 0.000375989 s + everything else: 0.0103126 s ..Running test_arith_sequence Running test_at_time @@ -12760,18 +12707,18 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.0257369 s +time for set_epsilon = 0.0650279 s ----------- creating output file "./simulation-ez-000100.00.h5"... run 0 finished at t = 200.0 (8000 timesteps) Field time usage: - connecting chunks: 0.00656203 s - time stepping: 0.663132 s - communicating: 0.0596894 s - outputting fields: 0.00780098 s - Fourier transforming: 0.000775545 s - everything else: 0.0554348 s + connecting chunks: 0.0164209 s + time stepping: 1.55375 s + communicating: 0.214466 s + outputting fields: 0.988966 s + Fourier transforming: 0.00664067 s + everything else: 0.140868 s .Running test_epsilon_input_file ----------- @@ -12781,16 +12728,16 @@ read in 1000x1000x1 epsilon-input-file "/build/meep-1.7.0/python/tests/../../libmeepgeom/cyl-ellipsoid-eps-ref.h5" Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.0337671 s +time for set_epsilon = 0.0852781 s ----------- run 0 finished at t = 200.0 (8000 timesteps) Field time usage: - connecting chunks: 0.00657297 s - time stepping: 0.688872 s - communicating: 0.0618694 s - Fourier transforming: 0.00072508 s - everything else: 0.0361099 s + connecting chunks: 0.0174089 s + time stepping: 1.4171 s + communicating: 0.161434 s + Fourier transforming: 0.00547256 s + everything else: 0.0735492 s ----------- Initializing structure... @@ -12799,16 +12746,16 @@ read in 1000x1000x1 epsilon-input-file "/build/meep-1.7.0/python/tests/../../libmeepgeom/cyl-ellipsoid-eps-ref.h5" Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.03392 s +time for set_epsilon = 0.078437 s ----------- run 0 finished at t = 200.0 (8000 timesteps) Field time usage: - connecting chunks: 0.00656797 s - time stepping: 0.686757 s - communicating: 0.0618554 s - Fourier transforming: 0.000716808 s - everything else: 0.0362285 s + connecting chunks: 0.0150031 s + time stepping: 1.45092 s + communicating: 0.169441 s + Fourier transforming: 0.00578875 s + everything else: 0.0755718 s .Running test_epsilon_warning ----------- @@ -12820,17 +12767,17 @@ sphere, center = (0,0,0) radius 0.2 dielectric constant epsilon diagonal = (-1.366,-1.366,-1.366) -time for set_epsilon = 0.0262011 s +time for set_epsilon = 0.0633109 s drude susceptibility: frequency=16.1085, gamma=6.74038 ----------- run 0 finished at t = 5.0 (200 timesteps) Field time usage: - connecting chunks: 0.00882094 s - time stepping: 0.0230385 s - communicating: 0.0017385 s - Fourier transforming: 1.9916e-05 s - everything else: 0.00125602 s + connecting chunks: 0.0167169 s + time stepping: 0.0488288 s + communicating: 0.0044883 s + Fourier transforming: 0.000173698 s + everything else: 0.00246476 s ----------- Initializing structure... @@ -12841,17 +12788,17 @@ sphere, center = (0,0,0) radius 0.2 dielectric constant epsilon diagonal = (1,1,1) -time for set_epsilon = 0.028723 s +time for set_epsilon = 0.067372 s lorentzian susceptibility: frequency=9.67865, gamma=0.0806554 ----------- run 0 finished at t = 5.0 (200 timesteps) Field time usage: - connecting chunks: 0.00958891 s - time stepping: 0.0237879 s - communicating: 0.00190275 s - Fourier transforming: 1.01941e-05 s - everything else: 0.00113657 s + connecting chunks: 0.0198228 s + time stepping: 0.0541445 s + communicating: 0.00503925 s + Fourier transforming: 0.000158554 s + everything else: 0.00247079 s .Running test_extra_materials ----------- @@ -12860,16 +12807,16 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.02624 s +time for set_epsilon = 0.0548511 s ----------- run 0 finished at t = 5.0 (200 timesteps) Field time usage: - connecting chunks: 0.00660709 s - time stepping: 0.0165673 s - communicating: 0.00151711 s - Fourier transforming: 1.79008e-05 s - everything else: 0.00125497 s + connecting chunks: 0.0158988 s + time stepping: 0.0366206 s + communicating: 0.00417172 s + Fourier transforming: 0.000149406 s + everything else: 0.00261343 s .Running test_geometry_center ----------- @@ -12880,16 +12827,16 @@ size (1e+20,3,1e+20) axes (1,0,0), (0,1,0), (0,0,1) dielectric constant epsilon diagonal = (12,12,12) -time for set_epsilon = 0.129433 s +time for set_epsilon = 0.269067 s ----------- run 0 finished at t = 50.0 (2000 timesteps) Field time usage: - connecting chunks: 0.0164341 s - time stepping: 0.602822 s - communicating: 0.0535772 s - Fourier transforming: 0.000258304 s - everything else: 0.0123228 s + connecting chunks: 0.035667 s + time stepping: 1.30624 s + communicating: 0.112485 s + Fourier transforming: 0.00180729 s + everything else: 0.0411561 s .Running test_get_array_output ----------- @@ -12899,7 +12846,7 @@ cylinder, center = (0,0,0) radius 0.2, height 1e+20, axis (0, 0, 1) dielectric constant epsilon diagonal = (9,9,9) -time for set_epsilon = 0.109532 s +time for set_epsilon = 0.205391 s ----------- run 0 finished at t = 20.0 (800 timesteps) creating output file "./test_get_array_output-eps-000020.00.h5"... @@ -12908,12 +12855,12 @@ creating output file "./test_get_array_output-e-000020.00.h5"... Field time usage: - connecting chunks: 0.0171041 s - time stepping: 0.234145 s - communicating: 0.0205733 s - outputting fields: 0.065993 s - Fourier transforming: 9.375e-05 s - everything else: 0.00568803 s + connecting chunks: 0.040766 s + time stepping: 0.498171 s + communicating: 0.0428762 s + outputting fields: 0.728805 s + Fourier transforming: 0.000689504 s + everything else: 0.0431517 s .F.Running test_get_center_and_size Running test_get_filename_prefix @@ -12922,49 +12869,49 @@ Initializing structure... Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 10 -time for set_epsilon = 0.0241371 s +time for set_epsilon = 0.0595949 s ----------- harminv0:, frequency, imag. freq., Q, |amp|, amplitude, error run 0 finished at t = 15.0 (300 timesteps) Field time usage: - connecting chunks: 0.000580081 s - time stepping: 0.0134968 s - communicating: 0.000521161 s - Fourier transforming: 1.3749e-05 s - everything else: 0.00331983 s + connecting chunks: 0.000928072 s + time stepping: 0.0297525 s + communicating: 0.00275411 s + Fourier transforming: 0.000179749 s + everything else: 0.0148134 s ----------- Initializing structure... Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 10 -time for set_epsilon = 0.0249849 s +time for set_epsilon = 0.057671 s ----------- harminv0:, frequency, imag. freq., Q, |amp|, amplitude, error run 0 finished at t = 15.0 (300 timesteps) Field time usage: - connecting chunks: 0.000580946 s - time stepping: 0.0134763 s - communicating: 0.000527711 s - Fourier transforming: 1.88306e-05 s - everything else: 0.003396 s + connecting chunks: 0.000943902 s + time stepping: 0.0310888 s + communicating: 0.00283844 s + Fourier transforming: 0.00022341 s + everything else: 0.0071773 s ----------- Initializing structure... Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 10 -time for set_epsilon = 0.025943 s +time for set_epsilon = 0.0566401 s ----------- harminv0:, frequency, imag. freq., Q, |amp|, amplitude, error run 0 finished at t = 15.0 (300 timesteps) Field time usage: - connecting chunks: 0.000626014 s - time stepping: 0.0142344 s - communicating: 0.000504919 s - Fourier transforming: 2.79815e-05 s - everything else: 0.00344217 s + connecting chunks: 0.00121897 s + time stepping: 0.0328016 s + communicating: 0.00296152 s + Fourier transforming: 0.000219351 s + everything else: 0.00770502 s .Running test_in_box_volumes ----------- @@ -12973,16 +12920,16 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.0265081 s +time for set_epsilon = 0.060037 s ----------- run 0 finished at t = 200.0 (8000 timesteps) Field time usage: - connecting chunks: 0.00664319 s - time stepping: 0.680977 s - communicating: 0.0610576 s - Fourier transforming: 0.000760288 s - everything else: 0.196771 s + connecting chunks: 0.019613 s + time stepping: 1.3699 s + communicating: 0.160541 s + Fourier transforming: 0.00534015 s + everything else: 0.351584 s .Running test_in_point ----------- @@ -12991,18 +12938,18 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.026494 s +time for set_epsilon = 0.0479271 s ----------- creating output file "./test_in_point-ez-000200.00.h5"... run 0 finished at t = 200.0 (8000 timesteps) Field time usage: - connecting chunks: 0.00672785 s - time stepping: 0.688962 s - communicating: 0.0622129 s - outputting fields: 0.000594 s - Fourier transforming: 0.00077421 s - everything else: 0.0457668 s + connecting chunks: 0.0139071 s + time stepping: 1.43732 s + communicating: 0.16118 s + outputting fields: 0.00834599 s + Fourier transforming: 0.00546618 s + everything else: 0.0900665 s .Running test_in_volume ----------- @@ -13011,18 +12958,18 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.026017 s +time for set_epsilon = 0.0671341 s ----------- creating output file "./test_in_volume-ez-000200.00.h5"... run 0 finished at t = 200.0 (8000 timesteps) Field time usage: - connecting chunks: 0.00680998 s - time stepping: 0.674136 s - communicating: 0.0601308 s - outputting fields: 0.00052711 s - Fourier transforming: 0.000782458 s - everything else: 0.044182 s + connecting chunks: 0.0174322 s + time stepping: 1.4773 s + communicating: 0.17245 s + outputting fields: 0.00839597 s + Fourier transforming: 0.00585917 s + everything else: 0.100428 s .Running test_infer_dimensions ----------- @@ -13031,7 +12978,7 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.0271609 s +time for set_epsilon = 0.0611379 s ----------- ...Running test_interpolate_numbers Running test_interpolate_vectors @@ -13048,42 +12995,54 @@ size (1,1,1e+20) axes (1,0,0), (0,1,0), (0,0,1) dielectric constant epsilon diagonal = (13,13,13) -time for set_epsilon = 0.177768 s +time for set_epsilon = 0.441296 s lorentzian susceptibility: frequency=2.80116, gamma=2.72777 lorentzian susceptibility: frequency=1.45825, gamma=1.08966 lorentzian susceptibility: frequency=1.24532, gamma=0.251645 lorentzian susceptibility: frequency=0.130662, gamma=0.268583 drude susceptibility: frequency=1e-10, gamma=0.0379081 ----------- -Meep progress: 29.41/50.0 = 58.8% done in 4.0s, 2.8s to go -on time step 2941 (time=29.41), 0.00136042 s/step +Meep progress: 11.09/50.0 = 22.2% done in 4.0s, 14.0s to go +on time step 1109 (time=11.09), 0.00360845 s/step +Meep progress: 22.4/50.0 = 44.8% done in 8.0s, 9.9s to go +on time step 2242 (time=22.42), 0.0035328 s/step +Meep progress: 33.74/50.0 = 67.5% done in 12.0s, 5.8s to go +on time step 3377 (time=33.77), 0.00352481 s/step +Meep progress: 45.33/50.0 = 90.7% done in 16.0s, 1.6s to go +on time step 4538 (time=45.38), 0.00344676 s/step run 0 finished at t = 50.0 (5000 timesteps) creating epsilon output file "test_load_dump_structure.h5"... Field time usage: - connecting chunks: 0.029943 s - time stepping: 6.39246 s - communicating: 0.308321 s - Fourier transforming: 0.000751281 s - everything else: 0.072466 s + connecting chunks: 0.0640533 s + time stepping: 16.4336 s + communicating: 0.913826 s + Fourier transforming: 0.00574262 s + everything else: 0.256086 s ----------- Initializing structure... Working in 2D dimensions. Computational cell is 5 x 5 x 0 with resolution 50 -time for set_epsilon = 0.156329 s +time for set_epsilon = 0.338724 s ----------- reading epsilon from file "test_load_dump_structure.h5"... -Meep progress: 28.97/50.0 = 57.9% done in 4.0s, 2.9s to go -on time step 2897 (time=28.97), 0.00138107 s/step +Meep progress: 8.89/50.0 = 17.8% done in 4.0s, 18.5s to go +on time step 889 (time=8.89), 0.00450271 s/step +Meep progress: 18.07/50.0 = 36.1% done in 8.0s, 14.1s to go +on time step 1808 (time=18.08), 0.00435571 s/step +Meep progress: 28.94/50.0 = 57.9% done in 12.0s, 8.7s to go +on time step 2895 (time=28.95), 0.00368046 s/step +Meep progress: 40.17/50.0 = 80.3% done in 16.0s, 3.9s to go +on time step 4018 (time=40.18), 0.0035642 s/step run 0 finished at t = 50.0 (5000 timesteps) Field time usage: - connecting chunks: 0.029274 s - time stepping: 6.45649 s - communicating: 0.317889 s - Fourier transforming: 0.000765355 s - everything else: 0.0739982 s + connecting chunks: 0.0518309 s + time stepping: 18.0724 s + communicating: 0.999209 s + Fourier transforming: 0.00623468 s + everything else: 0.283914 s .Running test_modal_volume_in_box ----------- @@ -13092,16 +13051,16 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.0260671 s +time for set_epsilon = 0.0487981 s ----------- run 0 finished at t = 200.0 (8000 timesteps) Field time usage: - connecting chunks: 0.00670073 s - time stepping: 0.692355 s - communicating: 0.0607155 s - Fourier transforming: 0.000776493 s - everything else: 0.0382962 s + connecting chunks: 0.0115051 s + time stepping: 1.34717 s + communicating: 0.158476 s + Fourier transforming: 0.00567283 s + everything else: 0.067886 s .sRunning test_numpy_epsilon ----------- @@ -13111,16 +13070,16 @@ read in 1000x1000x1 numpy array for epsilon Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.0342889 s +time for set_epsilon = 0.067322 s ----------- run 0 finished at t = 200.0 (8000 timesteps) Field time usage: - connecting chunks: 0.00664105 s - time stepping: 0.675788 s - communicating: 0.0621768 s - Fourier transforming: 0.00071396 s - everything else: 0.0364396 s + connecting chunks: 0.0117071 s + time stepping: 1.33704 s + communicating: 0.155473 s + Fourier transforming: 0.00535725 s + everything else: 0.0646892 s .Running test_require_dimensions ----------- @@ -13129,7 +13088,7 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.025675 s +time for set_epsilon = 0.0577861 s ----------- .Running test_set_materials ----------- @@ -13145,7 +13104,7 @@ size (1,2,1e+20) axes (1,0,0), (0,1,0), (0,0,1) dielectric constant epsilon diagonal = (1,1,1) -time for set_epsilon = 0.050287 s +time for set_epsilon = 0.0817521 s ----------- Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 16 @@ -13156,17 +13115,17 @@ size (1,2,1e+20) axes (1,0,0), (0,1,0), (0,0,1) dielectric constant epsilon diagonal = (1,1,1) -time for set_epsilon = 0.0223791 s +time for set_epsilon = 0.038997 s ----------- run 0 finished at t = 200.0 (6400 timesteps) Field time usage: - connecting chunks: 0.004066 s - time stepping: 0.512368 s - communicating: 0.041089 s - outputting fields: 0.00758892 s - Fourier transforming: 0.000595611 s - everything else: 0.0881659 s + connecting chunks: 0.00751713 s + time stepping: 1.05265 s + communicating: 0.104423 s + outputting fields: 0.0148691 s + Fourier transforming: 0.00427171 s + everything else: 0.167954 s .Running test_synchronized_magnetic ----------- @@ -13177,7 +13136,7 @@ size (1e+20,1,1e+20) axes (1,0,0), (0,1,0), (0,0,1) dielectric constant epsilon diagonal = (12,12,12) -time for set_epsilon = 0.0428111 s +time for set_epsilon = 0.0742831 s ----------- creating output file "./simulation-by-000000.00.h5"... creating output file "./simulation-by-000000.05.h5"... @@ -13259,6 +13218,8 @@ creating output file "./simulation-by-000003.85.h5"... creating output file "./simulation-by-000003.90.h5"... creating output file "./simulation-by-000003.95.h5"... +Meep progress: 3.95/10.0 = 39.5% done in 4.2s, 6.5s to go +on time step 79 (time=3.95), 0.0535216 s/step creating output file "./simulation-by-000004.00.h5"... creating output file "./simulation-by-000004.05.h5"... creating output file "./simulation-by-000004.10.h5"... @@ -13295,6 +13256,8 @@ creating output file "./simulation-by-000005.65.h5"... creating output file "./simulation-by-000005.70.h5"... creating output file "./simulation-by-000005.75.h5"... +Meep progress: 5.75/10.0 = 57.5% done in 8.3s, 6.1s to go +on time step 115 (time=5.75), 0.111539 s/step creating output file "./simulation-by-000005.80.h5"... creating output file "./simulation-by-000005.85.h5"... creating output file "./simulation-by-000005.90.h5"... @@ -13383,12 +13346,12 @@ run 0 finished at t = 10.0 (200 timesteps) Field time usage: - connecting chunks: 0.00917921 s - time stepping: 0.0406626 s - communicating: 0.0065486 s - outputting fields: 0.253341 s - Fourier transforming: 4.95972e-05 s - everything else: 0.0457213 s + connecting chunks: 0.0155729 s + time stepping: 0.148395 s + communicating: 0.0220096 s + outputting fields: 10.5401 s + Fourier transforming: 0.000308596 s + everything else: 1.17599 s .Running test_use_output_directory_custom ----------- @@ -13397,7 +13360,7 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.0268241 s +time for set_epsilon = 0.061691 s ----------- Meep: using output directory 'custom_dir' creating output file "custom_dir/simulation-ez-000200.00.h5"... @@ -13409,7 +13372,7 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.0254849 s +time for set_epsilon = 0.0539429 s ----------- Meep: using output directory 'simulation-out' creating output file "simulation-out/simulation-ez-000200.00.h5"... @@ -13434,18 +13397,18 @@ Halving computational cell along direction y Working in 2D dimensions. Computational cell is 10 x 10 x 0 with resolution 20 -time for set_epsilon = 0.0268211 s +time for set_epsilon = 0.0491901 s ----------- creating output file "./test_prefix-simulation-ez-000200.00.h5"... run 0 finished at t = 200.0 (8000 timesteps) Field time usage: - connecting chunks: 0.00696795 s - time stepping: 0.666366 s - communicating: 0.059075 s - outputting fields: 0.00750207 s - Fourier transforming: 0.000656709 s - everything else: 0.0977969 s + connecting chunks: 0.0120289 s + time stepping: 1.36583 s + communicating: 0.146724 s + outputting fields: 0.843809 s + Fourier transforming: 0.00527996 s + everything else: 0.370169 s . ====================================================================== @@ -13457,28 +13420,28 @@ AssertionError: False is not true ---------------------------------------------------------------------- -Ran 28 tests in 26.494s +Ran 28 tests in 81.870s FAILED (failures=1, skipped=1) -Elapsed run time = 26.4944 s +Elapsed run time = 81.8721 s Field time usage: - connecting chunks: 0.0065643 s - time stepping: 0.674556 s - communicating: 0.0596911 s - outputting fields: 0.00761888 s - Fourier transforming: 0.000716767 s - everything else: 0.0437507 s + connecting chunks: 0.0176798 s + time stepping: 1.47201 s + communicating: 0.167865 s + outputting fields: 0.0431829 s + Fourier transforming: 0.00593326 s + everything else: 0.112566 s Field time usage: - connecting chunks: 0.00669615 s - time stepping: 0.674687 s - communicating: 0.0603944 s - outputting fields: 0.00814092 s - Fourier transforming: 0.000749394 s - everything else: 0.0433903 s + connecting chunks: 0.011887 s + time stepping: 2.27156 s + communicating: 0.282759 s + outputting fields: 0.014917 s + Fourier transforming: 0.0173629 s + everything else: 0.139484 s FAIL tests/simulation.py (exit status: 1) @@ -13500,7 +13463,7 @@ make[4]: Entering directory '/build/meep-1.7.0/src' make[5]: Entering directory '/build/meep-1.7.0/src' /bin/mkdir -p '/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu' - /bin/bash ../libtool --mode=install /usr/bin/install -c libmeep.la '/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu' + /bin/sh ../libtool --mode=install /usr/bin/install -c libmeep.la '/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu' libtool: install: /usr/bin/install -c .libs/libmeep.so.12.0.0 /build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 libtool: install: (cd /build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu && { ln -s -f libmeep.so.12.0.0 libmeep.so.12 || { rm -f libmeep.so.12 && ln -s libmeep.so.12.0.0 libmeep.so.12; }; }) libtool: install: (cd /build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu && { ln -s -f libmeep.so.12.0.0 libmeep.so || { rm -f libmeep.so && ln -s libmeep.so.12.0.0 libmeep.so; }; }) @@ -13529,7 +13492,7 @@ make[4]: Entering directory '/build/meep-1.7.0/scheme' make[5]: Entering directory '/build/meep-1.7.0/scheme' /bin/mkdir -p '/build/meep-1.7.0/debian/tmp/usr/bin' - /bin/bash ../libtool --mode=install /usr/bin/install -c meep '/build/meep-1.7.0/debian/tmp/usr/bin' + /bin/sh ../libtool --mode=install /usr/bin/install -c meep '/build/meep-1.7.0/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/meep-1.7.0/debian/tmp/usr/bin/meep /bin/mkdir -p '/build/meep-1.7.0/debian/tmp/usr/share/meep' @@ -13541,9 +13504,9 @@ make[3]: Entering directory '/build/meep-1.7.0/libmeepgeom' make[4]: Entering directory '/build/meep-1.7.0/libmeepgeom' /bin/mkdir -p '/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu' - /bin/bash ../libtool --mode=install /usr/bin/install -c libmeepgeom.la '/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu' + /bin/sh ../libtool --mode=install /usr/bin/install -c libmeepgeom.la '/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu' libtool: warning: relinking 'libmeepgeom.la' -libtool: install: (cd /build/meep-1.7.0/libmeepgeom; /bin/bash "/build/meep-1.7.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libmeepgeom.la -rpath /usr/lib/i386-linux-gnu meepgeom.lo GDSIIgeom.lo ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/meep-1.7.0/debian/tmp) +libtool: install: (cd /build/meep-1.7.0/libmeepgeom; /bin/sh "/build/meep-1.7.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o libmeepgeom.la -rpath /usr/lib/i386-linux-gnu meepgeom.lo GDSIIgeom.lo ../src/libmeep.la -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/meep-1.7.0/debian/tmp) libtool: relink: i686-linux-gnu-g++ -fPIC -DPIC -shared -nostdlib /usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/8/crtbeginS.o .libs/meepgeom.o .libs/GDSIIgeom.o -L/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu -L/usr/lib/i386-linux-gnu -lmeep -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/8/crtendS.o /usr/lib/gcc/i686-linux-gnu/8/../../../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,libmeepgeom.so.12 -o .libs/libmeepgeom.so.12.0.0 libtool: install: /usr/bin/install -c .libs/libmeepgeom.so.12.0.0T /build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 libtool: install: (cd /build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu && { ln -s -f libmeepgeom.so.12.0.0 libmeepgeom.so.12 || { rm -f libmeepgeom.so.12 && ln -s libmeepgeom.so.12.0.0 libmeepgeom.so.12; }; }) @@ -13561,9 +13524,9 @@ make[3]: Entering directory '/build/meep-1.7.0/libpympb' make[4]: Entering directory '/build/meep-1.7.0/libpympb' /bin/mkdir -p '/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu' - /bin/bash ../libtool --mode=install /usr/bin/install -c libpympb.la '/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu' + /bin/sh ../libtool --mode=install /usr/bin/install -c libpympb.la '/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu' libtool: warning: relinking 'libpympb.la' -libtool: install: (cd /build/meep-1.7.0/libpympb; /bin/bash "/build/meep-1.7.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 12:0:0 -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 -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/meep-1.7.0/debian/tmp) +libtool: install: (cd /build/meep-1.7.0/libpympb; /bin/sh "/build/meep-1.7.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -version-info 12:0:0 -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 -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/meep-1.7.0/debian/tmp) libtool: relink: i686-linux-gnu-g++ -fPIC -DPIC -shared -nostdlib /usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/8/crtbeginS.o .libs/libpympb_la-pympb.o -L/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu -L/usr/lib/i386-linux-gnu -lmeep -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/8/crtendS.o /usr/lib/gcc/i686-linux-gnu/8/../../../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.12 -o .libs/libpympb.so.12.0.0 libtool: install: /usr/bin/install -c .libs/libpympb.so.12.0.0T /build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 libtool: install: (cd /build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu && { ln -s -f libpympb.so.12.0.0 libpympb.so.12 || { rm -f libpympb.so.12 && ln -s libpympb.so.12.0.0 libpympb.so.12; }; }) @@ -13579,7 +13542,7 @@ make[3]: Leaving directory '/build/meep-1.7.0/libpympb' Making install in python make[3]: Entering directory '/build/meep-1.7.0/python' -/bin/bash: git: command not found +/bin/sh: git: command not found cp meep.py __init__.py echo "__version__ = ''" >> __init__.py if [[ "3.0.12" = 3.0.12 ]]; then \ @@ -13592,7 +13555,7 @@ fi make install-am make[4]: Entering directory '/build/meep-1.7.0/python' -/bin/bash: git: command not found +/bin/sh: git: command not found cp meep.py __init__.py echo "__version__ = ''" >> __init__.py if [[ "3.0.12" = 3.0.12 ]]; then \ @@ -13611,9 +13574,9 @@ cp ./solver.py ./mpb_data.py meep/mpb make[5]: Entering directory '/build/meep-1.7.0/python' /bin/mkdir -p '/build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep' - /bin/bash ../libtool --mode=install /usr/bin/install -c _meep.la '/build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep' + /bin/sh ../libtool --mode=install /usr/bin/install -c _meep.la '/build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep' libtool: warning: relinking '_meep.la' -libtool: install: (cd /build/meep-1.7.0/python; /bin/bash "/build/meep-1.7.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _meep.la -rpath /usr/lib/python2.7/dist-packages/meep _meep_la-meep-python.lo ../src/libmeep.la ../libmeepgeom/libmeepgeom.la -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/meep-1.7.0/debian/tmp) +libtool: install: (cd /build/meep-1.7.0/python; /bin/sh "/build/meep-1.7.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _meep.la -rpath /usr/lib/python2.7/dist-packages/meep _meep_la-meep-python.lo ../src/libmeep.la ../libmeepgeom/libmeepgeom.la -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/meep-1.7.0/debian/tmp) libtool: relink: i686-linux-gnu-g++ -fPIC -DPIC -shared -nostdlib /usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/8/crtbeginS.o .libs/_meep_la-meep-python.o -L/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu -L/usr/lib/i386-linux-gnu -lmeep -lmeepgeom -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/8/crtendS.o /usr/lib/gcc/i686-linux-gnu/8/../../../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.12 -o .libs/_meep.so.12.0.0 libtool: install: /usr/bin/install -c .libs/_meep.so.12.0.0T /build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 libtool: install: (cd /build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep && { ln -s -f _meep.so.12.0.0 _meep.so.12 || { rm -f _meep.so.12 && ln -s _meep.so.12.0.0 _meep.so.12; }; }) @@ -13623,7 +13586,7 @@ libtool: install: chmod 644 /build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep/_meep.a libtool: install: i686-linux-gnu-ranlib /build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep/_meep.a libtool: warning: remember to run 'libtool --finish /usr/lib/python2.7/dist-packages/meep' -/bin/bash: git: command not found +/bin/sh: git: command not found cp meep.py __init__.py echo "__version__ = ''" >> __init__.py if [[ "3.0.12" = 3.0.12 ]]; then \ @@ -13643,9 +13606,9 @@ /bin/mkdir -p '/build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep/mpb' /usr/bin/install -c -m 644 mpb.py solver.py mpb_data.py '/build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep/mpb' /bin/mkdir -p '/build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep/mpb' - /bin/bash ../libtool --mode=install /usr/bin/install -c _mpb.la '/build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep/mpb' + /bin/sh ../libtool --mode=install /usr/bin/install -c _mpb.la '/build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep/mpb' libtool: warning: relinking '_mpb.la' -libtool: install: (cd /build/meep-1.7.0/python; /bin/bash "/build/meep-1.7.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _mpb.la -rpath /usr/lib/python2.7/dist-packages/meep/mpb _mpb_la-mpb-python.lo ../libmeepgeom/libmeepgeom.la ../libpympb/libpympb.la -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/meep-1.7.0/debian/tmp) +libtool: install: (cd /build/meep-1.7.0/python; /bin/sh "/build/meep-1.7.0/libtool" --tag CXX --mode=relink i686-linux-gnu-g++ -g -O2 -ffile-prefix-map=/build/meep-1.7.0=. -fstack-protector-strong -Wformat -Werror=format-security -Wall -W -module -version-info 12:0:0 -Wl,-z,relro -Wl,-z,now -Wl,-L/usr/lib/i386-linux-gnu/hdf5/serial -o _mpb.la -rpath /usr/lib/python2.7/dist-packages/meep/mpb _mpb_la-mpb-python.lo ../libmeepgeom/libmeepgeom.la ../libpympb/libpympb.la -lctlgeom -lhdf5 -lz -lgsl -lgslcblas -lm -lmpb -lharminv -llapack -lcblas -lf77blas -latlas -lfftw3 -lm -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../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/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lm -lquadmath -inst-prefix-dir /build/meep-1.7.0/debian/tmp) libtool: relink: i686-linux-gnu-g++ -fPIC -DPIC -shared -nostdlib /usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu/crti.o /usr/lib/gcc/i686-linux-gnu/8/crtbeginS.o .libs/_mpb_la-mpb-python.o -L/build/meep-1.7.0/debian/tmp/usr/lib/i386-linux-gnu -L/usr/lib/i386-linux-gnu -lmeepgeom -lpympb -lctlgeom -lhdf5 -lz -lgsl -lgslcblas /usr/lib/libmpb.a -lharminv -llapack -lcblas -lf77blas -latlas -L/usr/lib/gcc/i686-linux-gnu/8 -L/usr/lib/gcc/i686-linux-gnu/8/../../../i386-linux-gnu -L/usr/lib/gcc/i686-linux-gnu/8/../../../../lib -L/lib/i386-linux-gnu -L/lib/../lib -L/usr/lib/../lib -L/usr/lib/gcc/i686-linux-gnu/8/../../.. -L/usr/lib/i386-linux-gnu/hdf5/serial -lfftw3 -lgfortran -lquadmath -lstdc++ -lm -lc -lgcc_s /usr/lib/gcc/i686-linux-gnu/8/crtendS.o /usr/lib/gcc/i686-linux-gnu/8/../../../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.12 -o .libs/_mpb.so.12.0.0 libtool: install: /usr/bin/install -c .libs/_mpb.so.12.0.0T /build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 libtool: install: (cd /build/meep-1.7.0/debian/tmp/usr/lib/python2.7/dist-packages/meep/mpb && { ln -s -f _mpb.so.12.0.0 _mpb.so.12 || { rm -f _mpb.so.12 && ln -s _mpb.so.12.0.0 _mpb.so.12; }; }) @@ -13693,70 +13656,70 @@ dh_strip dh_makeshlibs dh_shlibdeps -dpkg-shlibdeps: warning: symbol dimensions used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 contains an unresolvable reference to symbol PyFile_Type: it's probably a plugin +dpkg-shlibdeps: warning: 97 other similar warnings have been skipped (use -v to see them all) +dpkg-shlibdeps: warning: symbol destroy_geom_box_tree used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol adaptive_integration used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol default_material used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol normal_to_fixed_object used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries dpkg-shlibdeps: warning: symbol create_geom_box_tree0 used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol unit_vector3 used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol geometry_center used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries dpkg-shlibdeps: warning: symbol make_sphere used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol ensure_periodicity used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol default_material used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol geometry_lattice used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol destroy_geom_box_tree used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol vector3_equal used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol geom_box_tree_stats used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol box_overlap_with_object used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol material_of_unshifted_point_in_tree_inobject used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol geom_initialize used by debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 found in none of the libraries dpkg-shlibdeps: warning: 13 other similar warnings have been skipped (use -v to see them all) -dpkg-shlibdeps: warning: symbol create_geom_box_tree0 used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol _ZN9meep_geom13check_offdiagEPNS_13medium_structE used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol vector3_norm used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol dimensions used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol ensure_periodicity used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol default_material used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol _ZN9meep_geom18make_file_materialEPKc used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol make_hermitian_cmatrix3x3 used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol geom_fix_object used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: symbol point_in_periodic_fixed_objectp used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries -dpkg-shlibdeps: warning: 27 other similar warnings have been skipped (use -v to see them all) -dpkg-shlibdeps: warning: debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 contains an unresolvable reference to symbol PyExc_IndexError: it's probably a plugin -dpkg-shlibdeps: warning: 111 other similar warnings have been skipped (use -v to see them all) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 were not linked against libatlas.so.3 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 were not linked against libz.so.1 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 were not linked against libquadmath.so.0 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 were not linked against libgslcblas.so.0 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 were not linked against libcblas.so.3 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 were not linked against libgfortran.so.5 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libgc.so.1 (it uses none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libharminv.so.3 (it uses none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libcblas.so.3 (it uses none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libatlas.so.3 (it uses none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libhdf5_serial.so.103 (it uses none of the library's symbols) dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libgsl.so.23 (it uses none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libf77blas.so.3 (it uses none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libfftw3.so.3 (it uses none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libhdf5_serial.so.103 (it uses none of the library's symbols) dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libgslcblas.so.0 (it uses none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libcblas.so.3 (it uses none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libgc.so.1 (it uses none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libf77blas.so.3 (it uses none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libgfortran.so.5 (it uses none of the library's symbols) dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libz.so.1 (it uses none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libfftw3.so.3 (it uses none of the library's symbols) dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libquadmath.so.0 (it uses none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libgfortran.so.5 (it uses none of the library's symbols) dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against liblapack.so.3 (it uses none of the library's symbols) -dpkg-shlibdeps: warning: debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 contains an unresolvable reference to symbol PyObject_IsInstance: it's probably a plugin -dpkg-shlibdeps: warning: 97 other similar warnings have been skipped (use -v to see them all) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 were not linked against libhdf5_serial.so.103 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 were not linked against libgfortran.so.5 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 were not linked against libharminv.so.3 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 were not linked against libgsl.so.23 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 were not linked against libz.so.1 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 were not linked against libatlas.so.3 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 were not linked against libgslcblas.so.0 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 were not linked against libquadmath.so.0 (they use none of the library's symbols) -dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 were not linked against libcblas.so.3 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libharminv.so.3 (it uses none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/meep/usr/bin/meep was not linked against libatlas.so.3 (it uses none of the library's symbols) +dpkg-shlibdeps: warning: debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 contains an unresolvable reference to symbol PyComplex_ImagAsDouble: it's probably a plugin +dpkg-shlibdeps: warning: 111 other similar warnings have been skipped (use -v to see them all) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 were not linked against libatlas.so.3 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 were not linked against libgfortran.so.5 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 were not linked against libharminv.so.3 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 were not linked against libgslcblas.so.0 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 were not linked against libquadmath.so.0 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 were not linked against libz.so.1 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 were not linked against libhdf5_serial.so.103 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 were not linked against libgsl.so.23 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/python-meep/usr/lib/python2.7/dist-packages/meep/mpb/_mpb.so.12.0.0 debian/python-meep/usr/lib/python2.7/dist-packages/meep/_meep.so.12.0.0 were not linked against libcblas.so.3 (they use none of the library's symbols) +dpkg-shlibdeps: warning: symbol _ZN9meep_geom13check_offdiagEPNS_13medium_structE used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol _ZN9meep_geom18make_file_materialEPKc used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol geom_fix_object used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol make_cnumber used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol _ZN9meep_geom7is_fileEPv used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol geom_fix_objects0 used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol _ZN9meep_geom21epsilon_file_materialEPNS_13material_dataE7vector3 used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol box_overlap_with_object used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol vector3_equal used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: symbol display_geometric_object_info used by debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 found in none of the libraries +dpkg-shlibdeps: warning: 27 other similar warnings have been skipped (use -v to see them all) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 were not linked against libcblas.so.3 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 were not linked against libquadmath.so.0 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 were not linked against libgfortran.so.5 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 were not linked against libatlas.so.3 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 were not linked against libz.so.1 (they use none of the library's symbols) +dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/libmeep12/usr/lib/i386-linux-gnu/libmeepgeom.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libmeep.so.12.0.0 debian/libmeep12/usr/lib/i386-linux-gnu/libpympb.so.12.0.0 were not linked against libgslcblas.so.0 (they use none of the library's symbols) dh_installdeb dh_gencontrol dh_md5sums dh_builddeb +dpkg-deb: building package 'python-meep-dbgsym' in '../python-meep-dbgsym_1.7.0-3_i386.deb'. dpkg-deb: building package 'meep-dbgsym' in '../meep-dbgsym_1.7.0-3_i386.deb'. -dpkg-deb: building package 'meep' in '../meep_1.7.0-3_i386.deb'. dpkg-deb: building package 'libmeep12-dbgsym' in '../libmeep12-dbgsym_1.7.0-3_i386.deb'. dpkg-deb: building package 'libmeep12' in '../libmeep12_1.7.0-3_i386.deb'. +dpkg-deb: building package 'meep' in '../meep_1.7.0-3_i386.deb'. dpkg-deb: building package 'libmeep-dev' in '../libmeep-dev_1.7.0-3_i386.deb'. -dpkg-deb: building package 'python-meep-dbgsym' in '../python-meep-dbgsym_1.7.0-3_i386.deb'. dpkg-deb: building package 'python-meep' in '../python-meep_1.7.0-3_i386.deb'. dpkg-genbuildinfo --build=binary dpkg-genchanges --build=binary >../meep_1.7.0-3_i386.changes @@ -13764,12 +13727,14 @@ dpkg-source --after-build . dpkg-buildpackage: info: binary-only upload (no source included) I: copying local configuration +I: user script /srv/workspace/pbuilder/732/tmp/hooks/B01_cleanup starting +I: user script /srv/workspace/pbuilder/732/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/15499 and its subdirectories -I: Current time: Sun Oct 3 02:00:08 -12 2021 -I: pbuilder-time-stamp: 1633269608 +I: removing directory /srv/workspace/pbuilder/732 and its subdirectories +I: Current time: Mon Aug 31 22:33:40 +14 2020 +I: pbuilder-time-stamp: 1598862820