Diff of the two buildlogs: -- --- b1/build.log 2024-12-31 15:31:20.200127903 +0000 +++ b2/build.log 2024-12-31 15:34:32.811301191 +0000 @@ -1,6 +1,6 @@ I: pbuilder: network access will be disabled during build -I: Current time: Tue Dec 31 03:29:03 -12 2024 -I: pbuilder-time-stamp: 1735658943 +I: Current time: Tue Feb 3 11:55:12 +14 2026 +I: pbuilder-time-stamp: 1770069312 I: Building the build Environment I: extracting base tarball [/var/cache/pbuilder/trixie-reproducible-base.tgz] I: copying local configuration @@ -26,54 +26,86 @@ dpkg-source: info: unpacking libgridxc_2.0.2-1.debian.tar.xz I: using fakeroot in build. I: Installing the build-deps -I: user script /srv/workspace/pbuilder/30440/tmp/hooks/D02_print_environment starting +I: user script /srv/workspace/pbuilder/25046/tmp/hooks/D01_modify_environment starting +debug: Running on ionos6-i386. +I: Changing host+domainname to test build reproducibility +I: Adding a custom variable just for the fun of it... +I: Changing /bin/sh to bash +'/bin/sh' -> '/bin/bash' +lrwxrwxrwx 1 root root 9 Feb 2 21:56 /bin/sh -> /bin/bash +I: Setting pbuilder2's login shell to /bin/bash +I: Setting pbuilder2's GECOS to second user,second room,second work-phone,second home-phone,second other +I: user script /srv/workspace/pbuilder/25046/tmp/hooks/D01_modify_environment finished +I: user script /srv/workspace/pbuilder/25046/tmp/hooks/D02_print_environment starting I: set - BUILDDIR='/build/reproducible-path' - BUILDUSERGECOS='first user,first room,first work-phone,first home-phone,first other' - BUILDUSERNAME='pbuilder1' - BUILD_ARCH='i386' - DEBIAN_FRONTEND='noninteractive' - DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all parallel=11 ' - DISTRIBUTION='trixie' - HOME='/root' - HOST_ARCH='i386' + BASH=/bin/sh + BASHOPTS=checkwinsize:cmdhist:complete_fullquote:extquote:force_fignore:globasciiranges:globskipdots:hostcomplete:interactive_comments:patsub_replacement:progcomp:promptvars:sourcepath + BASH_ALIASES=() + BASH_ARGC=() + BASH_ARGV=() + BASH_CMDS=() + BASH_LINENO=([0]="12" [1]="0") + BASH_LOADABLES_PATH=/usr/local/lib/bash:/usr/lib/bash:/opt/local/lib/bash:/usr/pkg/lib/bash:/opt/pkg/lib/bash:. + BASH_SOURCE=([0]="/tmp/hooks/D02_print_environment" [1]="/tmp/hooks/D02_print_environment") + BASH_VERSINFO=([0]="5" [1]="2" [2]="37" [3]="1" [4]="release" [5]="i686-pc-linux-gnu") + BASH_VERSION='5.2.37(1)-release' + BUILDDIR=/build/reproducible-path + BUILDUSERGECOS='second user,second room,second work-phone,second home-phone,second other' + BUILDUSERNAME=pbuilder2 + BUILD_ARCH=i386 + DEBIAN_FRONTEND=noninteractive + DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all parallel=21 ' + DIRSTACK=() + DISTRIBUTION=trixie + EUID=0 + FUNCNAME=([0]="Echo" [1]="main") + GROUPS=() + HOME=/root + HOSTNAME=i-capture-the-hostname + HOSTTYPE=i686 + HOST_ARCH=i386 IFS=' ' - INVOCATION_ID='c392988433d949c686334efcefbbdf83' - 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='30440' - PS1='# ' - PS2='> ' + INVOCATION_ID=f7fe7d67e935482589f9742d79f7d886 + 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=25046 PS4='+ ' - PWD='/' - SHELL='/bin/bash' - SHLVL='2' - SUDO_COMMAND='/usr/bin/timeout -k 18.1h 18h /usr/bin/ionice -c 3 /usr/bin/nice /usr/sbin/pbuilder --build --configfile /srv/reproducible-results/rbuild-debian/r-b-build.jGuKd6cZ/pbuilderrc_p8Uz --distribution trixie --hookdir /etc/pbuilder/first-build-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/trixie-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.jGuKd6cZ/b1 --logfile b1/build.log libgridxc_2.0.2-1.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://46.16.76.132:3128' + 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/r-b-build.jGuKd6cZ/pbuilderrc_Dpfn --distribution trixie --hookdir /etc/pbuilder/rebuild-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/trixie-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.jGuKd6cZ/b2 --logfile b2/build.log libgridxc_2.0.2-1.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://213.165.73.152:3128 I: uname -a - Linux ionos2-i386 6.1.0-28-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.1.119-1 (2024-11-22) x86_64 GNU/Linux + Linux i-capture-the-hostname 6.1.0-28-amd64 #1 SMP PREEMPT_DYNAMIC Debian 6.1.119-1 (2024-11-22) x86_64 GNU/Linux I: ls -l /bin - lrwxrwxrwx 1 root root 7 Nov 22 14:40 /bin -> usr/bin -I: user script /srv/workspace/pbuilder/30440/tmp/hooks/D02_print_environment finished + lrwxrwxrwx 1 root root 7 Nov 22 2024 /bin -> usr/bin +I: user script /srv/workspace/pbuilder/25046/tmp/hooks/D02_print_environment finished -> Attempting to satisfy build-dependencies -> Creating pbuilder-satisfydepends-dummy package Package: pbuilder-satisfydepends-dummy @@ -182,7 +214,7 @@ Get: 63 http://deb.debian.org/debian trixie/main i386 pkgconf-bin i386 1.8.1-4 [30.6 kB] Get: 64 http://deb.debian.org/debian trixie/main i386 pkgconf i386 1.8.1-4 [26.2 kB] Get: 65 http://deb.debian.org/debian trixie/main i386 pkg-config i386 1.8.1-4 [14.0 kB] -Fetched 60.8 MB in 1s (52.3 MB/s) +Fetched 60.8 MB in 1s (46.8 MB/s) Preconfiguring packages ... Selecting previously unselected package libproc2-0: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 ... 19952 files and directories currently installed.) @@ -464,7 +496,11 @@ fakeroot is already the newest version (1.36.2-1). 0 upgraded, 0 newly installed, 0 to remove and 0 not upgraded. I: Building the package -I: Running cd /build/reproducible-path/libgridxc-2.0.2/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-genchanges -S > ../libgridxc_2.0.2-1_source.changes +I: user script /srv/workspace/pbuilder/25046/tmp/hooks/A99_set_merged_usr starting +Not re-configuring usrmerge for trixie +I: user script /srv/workspace/pbuilder/25046/tmp/hooks/A99_set_merged_usr finished +hostname: Name or service not known +I: Running cd /build/reproducible-path/libgridxc-2.0.2/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-genchanges -S > ../libgridxc_2.0.2-1_source.changes dpkg-buildpackage: info: source package libgridxc dpkg-buildpackage: info: source version 2.0.2-1 dpkg-buildpackage: info: source distribution unstable @@ -521,8 +557,8 @@ -- Searching for libXC library - found -- Configuring docs -- Configuring libgridxc tests... --- Configuring done (2.1s) --- Generating done (0.1s) +-- Configuring done (0.8s) +-- Generating done (0.0s) CMake Warning: Manually-specified variables were not used by the project: @@ -534,7 +570,7 @@ -- Build files have been written to: /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2' dh_auto_build -O--buildsystem=cmake - cd obj-i686-linux-gnu && make -j11 "INSTALL=install --strip-program=true" VERBOSE=1 + cd obj-i686-linux-gnu && make -j21 "INSTALL=install --strip-program=true" VERBOSE=1 make[1]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' /usr/bin/cmake -S/build/reproducible-path/libgridxc-2.0.2 -B/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/CMakeFiles /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu//CMakeFiles/progress.marks @@ -549,68 +585,68 @@ make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make -f CMakeFiles/libgridxc-lib.dir/build.make CMakeFiles/libgridxc-lib.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -[ 1%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/precision.F90.o -[ 3%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o +[ 5%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o +[ 5%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/precision.F90.o +[ 5%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/gridxc_config.F90.o +[ 7%] 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+/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_config.mod CMakeFiles/libgridxc-lib.dir/gridxc_config.mod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/gridxc_config.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/precision.F90.o.provides.build -[ 11%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/xc_xwpbe.F90.o -[ 13%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o +/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_walltime.mod CMakeFiles/libgridxc-lib.dir/gridxc_walltime.mod.stamp GNU +[ 11%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/sorting.F90 -o 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CMakeFiles/libgridxc-lib.dir/src/array.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/interpolation.F90 -o CMakeFiles/libgridxc-lib.dir/src/interpolation.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_cellsubs.mod CMakeFiles/libgridxc-lib.dir/gridxc_cellsubs.mod.stamp GNU -[ 27%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/gridxc_fft_gpfa.F90.o -/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/gridxc_fft_gpfa.F90 -o CMakeFiles/libgridxc-lib.dir/src/gridxc_fft_gpfa.F90.o -/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/sys.F90.o.provides.build -[ 29%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o -/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/m_io.F90 -o CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/cellsubs.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_bessph.mod CMakeFiles/libgridxc-lib.dir/gridxc_bessph.mod.stamp GNU -/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_sorting.mod CMakeFiles/libgridxc-lib.dir/gridxc_sorting.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/bessph.F90.o.provides.build +/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_io.mod CMakeFiles/libgridxc-lib.dir/gridxc_io.mod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o.provides.build +/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_sorting.mod CMakeFiles/libgridxc-lib.dir/gridxc_sorting.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o.provides.build [ 31%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/minvec.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/minvec.F90 -o CMakeFiles/libgridxc-lib.dir/src/minvec.F90.o -/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_io.mod CMakeFiles/libgridxc-lib.dir/gridxc_io.mod.stamp GNU -/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o.provides.build +/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_am05.mod CMakeFiles/libgridxc-lib.dir/gridxc_am05.mod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/am05.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_lda.mod CMakeFiles/libgridxc-lib.dir/gridxc_lda.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/ldaxc.F90.o.provides.build -/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_am05.mod CMakeFiles/libgridxc-lib.dir/gridxc_am05.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_minvec.mod CMakeFiles/libgridxc-lib.dir/gridxc_minvec.mod.stamp GNU -/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/am05.F90.o.provides.build /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/minvec.F90.o.provides.build [ 33%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/chkgmx.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/chkgmx.F90 -o CMakeFiles/libgridxc-lib.dir/src/chkgmx.F90.o -/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_chkgmx.mod CMakeFiles/libgridxc-lib.dir/gridxc_chkgmx.mod.stamp GNU -/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/chkgmx.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_interpolation.mod CMakeFiles/libgridxc-lib.dir/gridxc_interpolation.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/interpolation.F90.o.provides.build [ 35%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/mesh1d.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/mesh1d.F90 -o CMakeFiles/libgridxc-lib.dir/src/mesh1d.F90.o +/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_chkgmx.mod CMakeFiles/libgridxc-lib.dir/gridxc_chkgmx.mod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/chkgmx.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_array.mod CMakeFiles/libgridxc-lib.dir/gridxc_array.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/array.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_mesh1d.mod CMakeFiles/libgridxc-lib.dir/gridxc_mesh1d.mod.stamp GNU @@ -619,16 +655,16 @@ /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/xc_xwpbe.F90.o.provides.build [ 37%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/xc_hybrids.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/xc_hybrids.F90 -o CMakeFiles/libgridxc-lib.dir/src/xc_hybrids.F90.o -/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_alloc.mod CMakeFiles/libgridxc-lib.dir/gridxc_alloc.mod.stamp GNU -/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o.provides.build -[ 39%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/mesh3d.F90.o -/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/mesh3d.F90 -o CMakeFiles/libgridxc-lib.dir/src/mesh3d.F90.o -[ 41%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o -/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/moreParallelSubs.F90 -o CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_hybrids.mod CMakeFiles/libgridxc-lib.dir/gridxc_hybrids.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/xc_hybrids.F90.o.provides.build -[ 43%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/ggaxc.F90.o +[ 39%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/ggaxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/ggaxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/ggaxc.F90.o +/usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_alloc.mod CMakeFiles/libgridxc-lib.dir/gridxc_alloc.mod.stamp GNU +/usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o.provides.build +[ 43%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/mesh3d.F90.o +[ 43%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/moreParallelSubs.F90 -o CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/mesh3d.F90 -o CMakeFiles/libgridxc-lib.dir/src/mesh3d.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_moreparallelsubs.mod CMakeFiles/libgridxc-lib.dir/gridxc_moreparallelsubs.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o.provides.build [ 45%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/debugxc.F90.o @@ -643,10 +679,10 @@ /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_gpfa_core_dp.mod CMakeFiles/libgridxc-lib.dir/gridxc_gpfa_core_dp.mod.stamp GNU /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_gpfa_core_sp.mod CMakeFiles/libgridxc-lib.dir/gridxc_gpfa_core_sp.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/gridxc_fft_gpfa.F90.o.provides.build -[ 47%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/radfft.F90.o -/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/radfft.F90 -o CMakeFiles/libgridxc-lib.dir/src/radfft.F90.o -[ 49%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/fft3d.F90.o +[ 47%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/fft3d.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/fft3d.F90 -o CMakeFiles/libgridxc-lib.dir/src/fft3d.F90.o +[ 49%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/radfft.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/radfft.F90 -o CMakeFiles/libgridxc-lib.dir/src/radfft.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_radfft.mod CMakeFiles/libgridxc-lib.dir/gridxc_radfft.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/radfft.F90.o.provides.build [ 50%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/vv_vdwxc.F90.o @@ -668,8 +704,8 @@ /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_xcmod.mod CMakeFiles/libgridxc-lib.dir/gridxc_xcmod.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/xcmod.F90.o.provides.build [ 58%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o -/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/atomxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o [ 60%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o +/usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/atomxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.0.2/src/cellxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_atom.mod CMakeFiles/libgridxc-lib.dir/gridxc_atom.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o.provides.build @@ -688,143 +724,143 @@ [ 64%] Built target libgridxc-lib make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/depend make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/depend +make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/depend +make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/depend +make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/depend +make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/depend +make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake "--color=" -make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/depend +make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/depend +make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/DependInfo.cmake "--color=" -make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/DependInfo.cmake "--color=" -make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/DependInfo.cmake "--color=" -make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/depend -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". -Scanning dependencies of target libgridxc-test1 make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake "--color=" -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake "--color=" +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/DependInfo.cmake "--color=" -make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/depend +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/depend.internal". +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/depend.internal". -make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/depend -Scanning dependencies of target libgridxc-test3 -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake "--color=" -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/depend.internal". -Scanning dependencies of target libgridxc-test4 Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/depend.internal". -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/depend.internal". -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/depend.internal". -Scanning dependencies of target libgridxc-test6 -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake "--color=" +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/depend.internal". +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/depend.internal". +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/depend.internal". +Scanning dependencies of target libgridxc-test1 +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/depend.internal". +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". Scanning dependencies of target libgridxc-test2 +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend.internal". +Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend.internal". +Scanning dependencies of target libgridxc-test3 +Scanning dependencies of target libgridxc-test4 make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/build +make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/build +Scanning dependencies of target libgridxc-test6 +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +Scanning dependencies of target libgridxc-test_libxc make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -[ 66%] Building Fortran object Testers/CMakeFiles/libgridxc-test1.dir/test1.f90.o -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/build -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend.internal". -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend.internal". -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test1.f90 -o CMakeFiles/libgridxc-test1.dir/test1.f90.o -Scanning dependencies of target libgridxc-test_libxc2 +Scanning dependencies of target libgridxc-test_hse06 +Scanning dependencies of target libgridxc-test_match +make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/build make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/build -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +Scanning dependencies of target libgridxc-test_libxc2 +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/build -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/depend.internal". -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/depend.internal". -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/depend.internal". -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/depend.internal". -make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/build -Scanning dependencies of target libgridxc-test_match +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -Scanning dependencies of target libgridxc-test_libxc -[ 68%] Building Fortran object Testers/CMakeFiles/libgridxc-test2.dir/test2.F90.o make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". -Dependee "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test2.F90 -o CMakeFiles/libgridxc-test2.dir/test2.F90.o make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/build -Scanning dependencies of target libgridxc-test_hse06 -[ 70%] Building Fortran object Testers/CMakeFiles/libgridxc-test3.dir/test3.F90.o -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test3.F90 -o CMakeFiles/libgridxc-test3.dir/test3.F90.o make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/build -[ 72%] Building Fortran object Testers/CMakeFiles/libgridxc-test4.dir/test4.F90.o -make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/build +make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/build +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +[ 70%] Building Fortran object Testers/CMakeFiles/libgridxc-test2.dir/test2.F90.o +[ 70%] Building Fortran object Testers/CMakeFiles/libgridxc-test4.dir/test4.F90.o +[ 70%] Building Fortran object Testers/CMakeFiles/libgridxc-test1.dir/test1.f90.o +[ 72%] Building Fortran object Testers/CMakeFiles/libgridxc-test3.dir/test3.F90.o cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test4.F90 -o CMakeFiles/libgridxc-test4.dir/test4.F90.o -[ 74%] Building Fortran object Testers/CMakeFiles/libgridxc-test6.dir/test6.f90.o -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test6.f90 -o CMakeFiles/libgridxc-test6.dir/test6.f90.o -[ 76%] Building Fortran object Testers/CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test_libxc.F90 -o CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test1.f90 -o CMakeFiles/libgridxc-test1.dir/test1.f90.o +[ 76%] Building Fortran object Testers/CMakeFiles/libgridxc-test_match.dir/test_match.F90.o +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test2.F90 -o CMakeFiles/libgridxc-test2.dir/test2.F90.o +[ 76%] Building Fortran object Testers/CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o [ 78%] Building Fortran object Testers/CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test_libxc2.F90 -o CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o -[ 82%] Building Fortran object Testers/CMakeFiles/libgridxc-test_match.dir/test_match.F90.o -[ 80%] Building Fortran object Testers/CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o +[ 82%] Building Fortran object Testers/CMakeFiles/libgridxc-test6.dir/test6.f90.o +[ 82%] Building Fortran object Testers/CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test3.F90 -o CMakeFiles/libgridxc-test3.dir/test3.F90.o cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test_hse06.F90 -o CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test_libxc2.F90 -o CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test_match.F90 -o CMakeFiles/libgridxc-test_match.dir/test_match.F90.o +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test6.f90 -o CMakeFiles/libgridxc-test6.dir/test6.f90.o +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace -c /build/reproducible-path/libgridxc-2.0.2/Testers/test_libxc.F90 -o CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o [ 84%] Linking Fortran executable libgridxc-test_match cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_match.dir/link.txt --verbose=1 [ 86%] Linking Fortran executable libgridxc-test_hse06 cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_hse06.dir/link.txt --verbose=1 /usr/bin/f95 -Wl,-z,relro -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_match.dir/test_match.F90.o" -o libgridxc-test_match ../libgridxc.a /usr/lib/i386-linux-gnu/libxcf03.so /usr/lib/i386-linux-gnu/libxc.so -[ 88%] Linking Fortran executable libgridxc-test_libxc2 -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_libxc2.dir/link.txt --verbose=1 -[ 90%] Linking Fortran executable libgridxc-test2 -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test2.dir/link.txt --verbose=1 /usr/bin/f95 -Wl,-z,relro -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o" -o libgridxc-test_hse06 ../libgridxc.a /usr/lib/i386-linux-gnu/libxcf03.so /usr/lib/i386-linux-gnu/libxc.so -[ 92%] Linking Fortran executable libgridxc-test_libxc +[ 88%] Linking Fortran executable libgridxc-test_libxc cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_libxc.dir/link.txt --verbose=1 +/usr/bin/f95 -Wl,-z,relro -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o" -o libgridxc-test_libxc ../libgridxc.a /usr/lib/i386-linux-gnu/libxcf03.so /usr/lib/i386-linux-gnu/libxc.so +[ 90%] Linking Fortran executable libgridxc-test_libxc2 +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_libxc2.dir/link.txt --verbose=1 /usr/bin/f95 -Wl,-z,relro -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o" -o libgridxc-test_libxc2 ../libgridxc.a /usr/lib/i386-linux-gnu/libxcf03.so /usr/lib/i386-linux-gnu/libxc.so +[ 92%] Linking Fortran executable libgridxc-test2 +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test2.dir/link.txt --verbose=1 /usr/bin/f95 -Wl,-z,relro -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test2.dir/test2.F90.o" -o libgridxc-test2 ../libgridxc.a /usr/lib/i386-linux-gnu/libxcf03.so /usr/lib/i386-linux-gnu/libxc.so -/usr/bin/f95 -Wl,-z,relro -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o" -o libgridxc-test_libxc ../libgridxc.a /usr/lib/i386-linux-gnu/libxcf03.so /usr/lib/i386-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -[ 94%] Linking Fortran executable libgridxc-test4 -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test4.dir/link.txt --verbose=1 -[ 94%] Built target libgridxc-test_match +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +[ 92%] Built target libgridxc-test_match +[ 92%] Built target libgridxc-test_hse06 +[ 92%] Built target libgridxc-test_libxc +[ 94%] Linking Fortran executable libgridxc-test6 +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test6.dir/link.txt --verbose=1 +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +/usr/bin/f95 -Wl,-z,relro -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test6.dir/test6.f90.o" -o libgridxc-test6 ../libgridxc.a /usr/lib/i386-linux-gnu/libxcf03.so /usr/lib/i386-linux-gnu/libxc.so +[ 94%] Built target libgridxc-test_libxc2 +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' [ 94%] Built target libgridxc-test2 make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +[ 94%] Built target libgridxc-test6 +[ 96%] Linking Fortran executable libgridxc-test4 +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test4.dir/link.txt --verbose=1 /usr/bin/f95 -Wl,-z,relro -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test4.dir/test4.F90.o" -o libgridxc-test4 ../libgridxc.a /usr/lib/i386-linux-gnu/libxcf03.so /usr/lib/i386-linux-gnu/libxc.so -[ 94%] Built target libgridxc-test_hse06 -[ 96%] Linking Fortran executable libgridxc-test6 -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test6.dir/link.txt --verbose=1 [ 98%] Linking Fortran executable libgridxc-test1 cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test1.dir/link.txt --verbose=1 make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' /usr/bin/f95 -Wl,-z,relro -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test1.dir/test1.f90.o" -o libgridxc-test1 ../libgridxc.a /usr/lib/i386-linux-gnu/libxcf03.so /usr/lib/i386-linux-gnu/libxc.so -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -/usr/bin/f95 -Wl,-z,relro -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test6.dir/test6.f90.o" -o libgridxc-test6 ../libgridxc.a /usr/lib/i386-linux-gnu/libxcf03.so /usr/lib/i386-linux-gnu/libxc.so -[ 98%] Built target libgridxc-test_libxc2 -[ 98%] Built target libgridxc-test_libxc -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' [ 98%] Built target libgridxc-test4 make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' [ 98%] Built target libgridxc-test1 -[ 98%] Built target libgridxc-test6 [100%] Linking Fortran executable libgridxc-test3 cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test3.dir/link.txt --verbose=1 /usr/bin/f95 -Wl,-z,relro -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.0.2=. -fstack-protector-strong -fallow-argument-mismatch -g -O2 -fbacktrace "CMakeFiles/libgridxc-test3.dir/test3.F90.o" -o libgridxc-test3 ../libgridxc.a /usr/lib/i386-linux-gnu/libxcf03.so /usr/lib/i386-linux-gnu/libxc.so @@ -834,10 +870,10 @@ /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/CMakeFiles 0 make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' dh_auto_test -O--buildsystem=cmake - cd obj-i686-linux-gnu && make -j11 test ARGS\+=--verbose ARGS\+=-j11 + cd obj-i686-linux-gnu && make -j21 test ARGS\+=--verbose ARGS\+=-j21 make[1]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' Running tests... -/usr/bin/ctest --force-new-ctest-process --verbose -j11 +/usr/bin/ctest --force-new-ctest-process --verbose -j21 UpdateCTestConfiguration from :/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/DartConfiguration.tcl UpdateCTestConfiguration from :/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/DartConfiguration.tcl Test project /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu @@ -1594,6 +1630,10 @@ 1: GGA AM05 0 3 Ex -0.013395786 -0.042764417 0.029368631 2 1: GGA AM05 0 3 Ec -0.031357668 -0.033352795 0.001995127 2 1: GGA AM05 0 4 Ex -0.008611008 0.000059691 0.008670699 2 +3: +3: funcs= VDW +3: auths= BH +3: nMesh, Ecut = 9 18 27 30.000000 1: GGA AM05 0 4 Ec -0.020157170 -0.020075330 0.000081839 2 1: GGA PW86 0 1 Ex -0.805886912 -0.831138866 0.025251954 2 1: GGA PW86 0 2 Ex -0.686764896 -0.661512942 0.025251953 2 @@ -1699,28 +1739,6 @@ 1: GGA PW91 0 2 Ex -0.784617337 -0.659815833 0.124801504 2 1: GGA PW91 0 3 Ex -0.004818303 -0.034176641 0.029358338 2 1: GGA PW91 0 4 Ex 0.009350044 -0.140698304 0.150048348 2 -1: GGA PBE 0 1 Ex -0.725823715 -0.818099776 0.092276060 2 -1: GGA PBE 0 2 Ex -0.767426544 -0.675150476 0.092276069 2 -1: GGA PBE 0 3 Ex 0.009915597 -0.119713412 0.129629009 2 -1: GGA PBE 0 4 Ex -0.019241477 -0.185799397 0.166557920 2 -1: GGA RPBE 0 1 Ex -0.854197157 -0.979919258 0.125722100 2 -1: GGA RPBE 0 2 Ex -0.852503316 -0.726781207 0.125722109 2 -1: GGA RPBE 0 3 Ex -0.000403709 -0.061684680 0.061280971 2 -1: GGA RPBE 0 4 Ex 0.000783409 -0.166710676 0.167494085 2 -1: GGA revPBE 0 1 Ex -0.710311822 -0.865243719 0.154931897 2 -1: GGA revPBE 0 2 Ex -0.722652790 -0.567720883 0.154931906 2 -1: GGA revPBE 0 3 Ex 0.002941340 -0.249537614 0.252478954 2 -1: GGA revPBE 0 4 Ex -0.005707748 -0.303308643 0.297600895 2 -1: GGA LYP 0 1 Ex -0.507914278 -0.676084962 0.168170684 2 -1: GGA LYP 0 1 Ec -0.124887661 -0.321005564 0.196117903 2 -1: GGA LYP 0 2 Ex -0.565218671 -0.397047987 0.168170684 2 -1: GGA LYP 0 2 Ec -0.144932498 0.051185404 0.196117903 2 -1: GGA LYP 0 3 Ex 0.013657900 -0.487624846 0.501282747 2 -1: GGA LYP 0 3 Ec 0.004777476 0.292531134 0.287753658 2 -3: -3: funcs= VDW -3: auths= BH -3: nMesh, Ecut = 9 18 27 30.000000 6: dr, rMax = 0.200000 20.000000 6: iSpin r dens Vxc dExc/dDens diff 6: 1 0.000 0.047620227 -1.002697110 @@ -1729,32 +1747,6 @@ 6: 1 0.600 0.045524817 -0.988809470 -0.988809531 0.000000060 6: 1 0.800 0.043959010 -0.977974562 -0.977974537 -0.000000024 6: 1 1.000 0.042024703 -0.964863927 -0.964863926 -0.000000001 -6: 1 1.200 0.039775757 -0.948686877 -0.948686876 -0.000000001 -6: 1 1.400 0.037272568 -0.930171029 -0.930171035 0.000000006 -6: 1 1.600 0.034579382 -0.909220984 -0.909220978 -0.000000007 -6: 1 1.800 0.031761587 -0.886131875 -0.886131871 -0.000000004 -6: 1 2.000 0.028883127 -0.861091739 -0.861091742 0.000000004 -6: 1 2.200 0.026004187 -0.834328425 -0.834328428 0.000000003 -6: 1 2.400 0.023179251 -0.806073217 -0.806073218 0.000000000 -6: 1 2.600 0.020455616 -0.776561113 -0.776561116 0.000000002 -6: 1 2.800 0.017872394 -0.746026275 -0.746026279 0.000000005 -6: 1 3.000 0.015460016 -0.714697437 -0.714697438 0.000000000 -6: 1 3.200 0.013240188 -0.682792452 -0.682792452 -0.000000001 -6: 1 3.400 0.011226266 -0.650510776 -0.650510775 -0.000000001 -6: 1 3.600 0.009423960 -0.618021733 -0.618021730 -0.000000002 -6: 1 3.800 0.007832284 -0.585445444 -0.585445443 -0.000000000 -6: 1 4.000 0.006444664 -0.552823710 -0.552823708 -0.000000002 -7: dr, rMax = 0.200000 20.000000 -7: iSpin r dens Vxc dExc/dDens diff -7: 1 0.000 0.047620227 -0.980238765 -7: 1 0.200 0.047382720 -0.982776277 -0.982776529 0.000000252 -7: 1 0.400 0.046677283 -0.990388812 -0.990388675 -0.000000138 -7: 1 0.600 0.045524817 -0.975266071 -0.975266034 -0.000000038 -7: 1 0.800 0.043959010 -0.975102121 -0.975102116 -0.000000004 -7: 1 1.000 0.042024703 -0.956001234 -0.956001256 0.000000022 -7: 1 1.200 0.039775757 -0.943081485 -0.943081490 0.000000005 -7: 1 1.400 0.037272568 -0.921422546 -0.921422546 -0.000000000 -7: 1 1.600 0.034579382 -0.899005838 -0.899005832 -0.000000007 8: Ex, Ec: -4.3915197423832808 -0.63516421031255166 8: -1.00270 -1.00104 -0.99606 -0.98881 -0.97797 -0.96486 8: -0.94869 -0.93017 -0.90922 -0.88613 -0.86109 -0.83433 @@ -1825,7 +1817,49 @@ 8: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 8: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 8: 0.00000 0.00000 0.00000 0.00000 -1/9 Test #8: libgridxc_test_match ............. Passed 0.04 sec +7: dr, rMax = 0.200000 20.000000 +7: iSpin r dens Vxc dExc/dDens diff +7: 1 0.000 0.047620227 -0.980238765 +7: 1 0.200 0.047382720 -0.982776277 -0.982776529 0.000000252 +7: 1 0.400 0.046677283 -0.990388812 -0.990388675 -0.000000138 +7: 1 0.600 0.045524817 -0.975266071 -0.975266034 -0.000000038 +9: Built-in Ex, Ec, sum: -4.35557595 -0.64530376 -5.00087971 +9: -0.96381 -0.96241 -0.95818 -0.95085 -0.94096 -0.92821 +9: -0.91301 -0.89533 -0.87543 -0.85345 -0.82960 -0.80409 +9: -0.77712 -0.74892 -0.71968 -0.68963 -0.65894 -0.62781 +9: -0.59638 -0.56477 -0.53302 -0.50110 -0.46885 -0.43600 +9: -0.40231 -0.36779 -0.33297 -0.29914 -0.26803 -0.24125 +9: -0.21962 -0.20283 -0.18970 -0.17872 -0.16848 -0.15809 +9: -0.14712 -0.13555 -0.12361 -0.11161 -0.09987 -0.08863 +9: -0.07810 -0.06838 -0.05953 -0.05157 -0.04446 -0.03816 +9: -0.03262 -0.02778 -0.02356 -0.01992 -0.01677 -0.01408 +9: -0.01177 -0.00981 -0.00815 -0.00674 -0.00556 -0.00457 +9: -0.00374 -0.00305 -0.00248 -0.00201 -0.00162 -0.00131 +9: -0.00105 -0.00084 -0.00067 -0.00053 -0.00042 -0.00036 +9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 +9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 +9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 +9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 +9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 +1/9 Test #8: libgridxc_test_match ............. Passed 0.01 sec +1: GGA PBE 0 1 Ex -0.725823715 -0.818099776 0.092276060 2 +1: GGA PBE 0 2 Ex -0.767426544 -0.675150476 0.092276069 2 +1: GGA PBE 0 3 Ex 0.009915597 -0.119713412 0.129629009 2 +1: GGA PBE 0 4 Ex -0.019241477 -0.185799397 0.166557920 2 +1: GGA RPBE 0 1 Ex -0.854197157 -0.979919258 0.125722100 2 +1: GGA RPBE 0 2 Ex -0.852503316 -0.726781207 0.125722109 2 +1: GGA RPBE 0 3 Ex -0.000403709 -0.061684680 0.061280971 2 +1: GGA RPBE 0 4 Ex 0.000783409 -0.166710676 0.167494085 2 +1: GGA revPBE 0 1 Ex -0.710311822 -0.865243719 0.154931897 2 +1: GGA revPBE 0 2 Ex -0.722652790 -0.567720883 0.154931906 2 +1: GGA revPBE 0 3 Ex 0.002941340 -0.249537614 0.252478954 2 +1: GGA revPBE 0 4 Ex -0.005707748 -0.303308643 0.297600895 2 +1: GGA LYP 0 1 Ex -0.507914278 -0.676084962 0.168170684 2 +1: GGA LYP 0 1 Ec -0.124887661 -0.321005564 0.196117903 2 +1: GGA LYP 0 2 Ex -0.565218671 -0.397047987 0.168170684 2 +1: GGA LYP 0 2 Ec -0.144932498 0.051185404 0.196117903 2 +1: GGA LYP 0 3 Ex 0.013657900 -0.487624846 0.501282747 2 +1: GGA LYP 0 3 Ec 0.004777476 0.292531134 0.287753658 2 1: GGA LYP 0 4 Ex -0.026503515 -0.466631148 0.440127634 2 1: GGA LYP 0 4 Ec -0.009270819 -0.073001911 0.063731093 2 1: GGA WC 0 1 Ex -0.674196998 -0.794408653 0.120211655 2 @@ -1854,50 +1888,17 @@ 1: GGA PBESOL 0 4 Ex -0.015897816 -0.213414277 0.197516460 2 1: GGA AM05 0 1 Ex -0.449595553 -0.556585398 0.106989845 2 1: GGA AM05 0 1 Ec -0.062600843 -0.062104457 0.000496387 2 -6: 1 4.200 0.005250115 -0.520082870 -0.520082869 -0.000000001 -9: Built-in Ex, Ec, sum: -4.35557595 -0.64530376 -5.00087971 -9: -0.96381 -0.96241 -0.95818 -0.95085 -0.94096 -0.92821 -9: -0.91301 -0.89533 -0.87543 -0.85345 -0.82960 -0.80409 -9: -0.77712 -0.74892 -0.71968 -0.68963 -0.65894 -0.62781 -9: -0.59638 -0.56477 -0.53302 -0.50110 -0.46885 -0.43600 -9: -0.40231 -0.36779 -0.33297 -0.29914 -0.26803 -0.24125 -9: -0.21962 -0.20283 -0.18970 -0.17872 -0.16848 -0.15809 -9: -0.14712 -0.13555 -0.12361 -0.11161 -0.09987 -0.08863 -9: -0.07810 -0.06838 -0.05953 -0.05157 -0.04446 -0.03816 -9: -0.03262 -0.02778 -0.02356 -0.01992 -0.01677 -0.01408 -9: -0.01177 -0.00981 -0.00815 -0.00674 -0.00556 -0.00457 -9: -0.00374 -0.00305 -0.00248 -0.00201 -0.00162 -0.00131 -9: -0.00105 -0.00084 -0.00067 -0.00053 -0.00042 -0.00036 -9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -9: -0.00036 -0.00036 -0.00036 -0.00036 -0.00036 -9: libxc Ex, Ec, sum: -2.09822342 -2.09822342 -4.19644685 -9: -0.77367 -0.77146 -0.76482 -0.76250 -0.75239 -0.74512 -9: -0.73278 -0.72042 -0.70583 -0.69001 -0.67289 -0.65467 -9: -0.63545 -0.61533 -0.59429 -0.57225 -0.54897 -0.52411 -9: -0.49730 -0.46848 -0.43849 -0.40992 -0.38698 -0.37290 -9: -0.36315 -0.34398 -0.30778 -0.26529 -0.23213 -0.21168 -9: -0.19843 -0.18753 -0.17708 -0.16672 -0.15639 -0.14595 -9: -0.13516 -0.12347 -0.11059 -0.10133 -0.09618 -0.08875 -9: -0.07873 -0.06891 -0.05991 -0.05182 -0.04462 -0.03827 -9: -0.03269 -0.02782 -0.02359 -0.01993 -0.01678 -0.01408 -9: -0.01177 -0.00981 -0.00815 -0.00674 -0.00556 -0.00457 -9: -0.00374 -0.00305 -0.00248 -0.00201 -0.00162 -0.00131 -9: -0.00105 -0.00084 -0.00067 -0.00053 -0.00042 -0.00033 -9: -0.00026 -0.00020 -0.00016 -0.00012 0.00000 0.00000 -9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -9: 0.00000 0.00000 0.00000 0.00000 0.00000 1: GGA AM05 0 2 Ex -0.508642275 -0.401652430 0.106989845 2 1: GGA AM05 0 2 Ec -0.050538962 -0.051035349 0.000496387 2 +6: 1 1.200 0.039775757 -0.948686877 -0.948686876 -0.000000001 +6: 1 1.400 0.037272568 -0.930171029 -0.930171035 0.000000006 +6: 1 1.600 0.034579382 -0.909220984 -0.909220978 -0.000000007 +7: 1 0.800 0.043959010 -0.975102121 -0.975102116 -0.000000004 +7: 1 1.000 0.042024703 -0.956001234 -0.956001256 0.000000022 1: GGA AM05 0 3 Ex 0.014073166 -0.320089313 0.334162479 2 1: GGA AM05 0 3 Ec -0.002874823 -0.002202170 0.000672653 2 1: GGA AM05 0 4 Ex -0.027309349 -0.315175013 0.287865664 2 1: GGA AM05 0 4 Ec 0.005578669 0.006461933 0.000883264 2 -2/9 Test #9: libgridxc_test_hse06 ............. Passed 0.02 sec 1: GGA PW86 0 1 Ex -0.658647390 -0.758228602 0.099581212 2 1: GGA PW86 0 2 Ex -0.722114275 -0.622533055 0.099581220 2 1: GGA PW86 0 3 Ex 0.015126665 -0.226427806 0.241554471 2 @@ -1907,15 +1908,32 @@ 1: GGA B88 0 3 Ex 0.013647522 -0.487590033 0.501237554 2 1: GGA B88 0 4 Ex -0.026483375 -0.466554555 0.440071181 2 1: GGA C09 0 1 Ex -0.462041569 -0.644090434 0.182048865 2 -7: 1 1.800 0.031761587 -0.874045663 -0.874045664 0.000000001 -6: 1 4.400 0.004234421 -0.487004137 -0.487004136 -0.000000000 1: GGA C09 0 2 Ex -0.476735617 -0.294686743 0.182048874 2 1: GGA C09 0 3 Ex 0.003502172 -0.441623130 0.445125301 2 1: GGA C09 0 4 Ex -0.006796057 -0.432987649 0.426191592 2 1: GGA BH 0 1 Ex -0.658980784 -0.796352347 0.137371563 2 +9: libxc Ex, Ec, sum: -2.09822342 -2.09822342 -4.19644685 1: GGA BH 0 2 Ex -0.678069463 -0.540697891 0.137371572 2 +9: -0.77367 -0.77146 -0.76482 -0.76250 -0.75239 -0.74512 +9: -0.73278 -0.72042 -0.70583 -0.69001 -0.67289 -0.65467 +9: -0.63545 -0.61533 -0.59429 -0.57225 -0.54897 -0.52411 +9: -0.49730 -0.46848 -0.43849 -0.40992 -0.38698 -0.37290 +9: -0.36315 -0.34398 -0.30778 -0.26529 -0.23213 -0.21168 +9: -0.19843 -0.18753 -0.17708 -0.16672 -0.15639 -0.14595 1: GGA BH 0 3 Ex 0.004549586 -0.227823749 0.232373336 2 +9: -0.13516 -0.12347 -0.11059 -0.10133 -0.09618 -0.08875 +9: -0.07873 -0.06891 -0.05991 -0.05182 -0.04462 -0.03827 +9: -0.03269 -0.02782 -0.02359 -0.01993 -0.01678 -0.01408 +9: -0.01177 -0.00981 -0.00815 -0.00674 -0.00556 -0.00457 +6: 1 1.800 0.031761587 -0.886131875 -0.886131871 -0.000000004 1: GGA BH 0 4 Ex -0.008828592 -0.277084604 0.268256012 2 +9: -0.00374 -0.00305 -0.00248 -0.00201 -0.00162 -0.00131 +9: -0.00105 -0.00084 -0.00067 -0.00053 -0.00042 -0.00033 +9: -0.00026 -0.00020 -0.00016 -0.00012 0.00000 0.00000 +9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 +9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 +9: 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 +9: 0.00000 0.00000 0.00000 0.00000 0.00000 1: 1: iSpin dens gradDens 1: 1 0.040316982 -0.078210355 -0.016953486 0.164317375 @@ -1929,6 +1947,7 @@ 1: GGA PBE 0 1 Ex -0.387488712 -0.265747973 0.121740739 2 1: GGA PBE 0 2 Ex -0.552672277 -0.674413005 0.121740728 2 1: GGA PBE 0 3 Ex 0.009642642 -0.644716303 0.654358945 2 +2/9 Test #9: libgridxc_test_hse06 ............. Passed 0.01 sec 1: GGA PBE 0 4 Ex 0.012097626 -0.297469931 0.309567557 2 1: GGA RPBE 0 1 Ex -0.354261439 -0.196947525 0.157313914 2 1: GGA RPBE 0 2 Ex -0.588479005 -0.745792907 0.157313902 2 @@ -1938,6 +1957,8 @@ 1: GGA revPBE 0 2 Ex -0.510195034 -0.691715380 0.181520345 2 1: GGA revPBE 0 3 Ex 0.008750550 -0.902428589 0.911179138 2 1: GGA revPBE 0 4 Ex 0.010978410 -0.502007549 0.512985959 2 +7: 1 1.200 0.039775757 -0.943081485 -0.943081490 0.000000005 +6: 1 2.000 0.028883127 -0.861091739 -0.861091742 0.000000004 1: GGA LYP 0 1 Ex -0.377941498 -0.181528867 0.196412631 2 1: GGA LYP 0 1 Ec 0.015375944 0.023612359 0.008236414 2 1: GGA LYP 0 2 Ex -0.421241060 -0.617653691 0.196412631 2 @@ -1955,9 +1976,11 @@ 1: GGA PBEJsJrLO 0 3 Ex 0.007047966 -0.593161360 0.600209327 2 1: GGA PBEJsJrLO 0 4 Ex 0.008842355 -0.320808955 0.329651310 2 1: GGA PBEJsJrHEG 0 1 Ex -0.399421073 -0.315833039 0.083588034 2 +6: 1 2.200 0.026004187 -0.834328425 -0.834328428 0.000000003 1: GGA PBEJsJrHEG 0 2 Ex 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-1.171110319 0.113500982 2 1: GGA PBEGcGxHEG 0 3 Ex -0.000460561 -0.072497561 0.072037000 2 1: GGA PBEGcGxHEG 0 4 Ex -0.026722158 -0.215622820 0.188900662 2 +6: 1 7.600 0.000034818 -0.129595146 -0.129595152 0.000000006 1: GGA PBESOL 0 1 Ex -1.122555666 -0.978886678 0.143668988 2 1: GGA PBESOL 0 2 Ex -1.025655339 -1.169324321 0.143668982 2 1: GGA PBESOL 0 3 Ex -0.000498462 -0.131489626 0.130991164 2 1: GGA PBESOL 0 4 Ex -0.028921200 -0.267344639 0.238423439 2 +7: 1 6.000 0.000528944 -0.223883655 -0.223883656 0.000000001 1: GGA AM05 0 1 Ex -1.106468965 -0.974836253 0.131632712 2 1: GGA AM05 0 1 Ec -0.062912624 -0.065360136 0.002447511 2 1: GGA AM05 0 2 Ex -0.762225460 -0.893858172 0.131632712 2 @@ -2765,6 +2682,7 @@ 1: GGA B88 0 1 Ex -1.093597005 -0.842693215 0.250903790 2 1: GGA B88 0 2 Ex -0.846752416 -1.097656198 0.250903781 2 1: GGA B88 0 3 Ex -0.001269786 -0.352481442 0.351211656 2 +6: 1 7.800 0.000023687 -0.117391049 -0.117391056 0.000000007 1: GGA B88 0 4 Ex -0.073674074 -0.487946790 0.414272716 2 1: GGA C09 0 1 Ex -1.089344687 -0.891770005 0.197574681 2 1: GGA C09 0 2 Ex -0.755809559 -0.953384233 0.197574674 2 @@ -2774,12 +2692,6 @@ 1: GGA BH 0 2 Ex -1.072760524 -1.236997262 0.164236738 2 1: GGA BH 0 3 Ex -0.000111165 -0.178267666 0.178156501 2 1: GGA BH 0 4 Ex -0.006449910 -0.278516527 0.272066617 2 -7: 2 1.400 0.024848378 -0.849409711 -0.849409715 0.000000004 -7: 2 1.600 0.023052921 -0.829194760 -0.829194765 0.000000006 -7: 2 1.800 0.021174391 -0.806916840 -0.806916837 -0.000000003 -7: 2 2.000 0.019255418 -0.783153757 -0.783153759 0.000000001 -7: 2 2.200 0.017336125 -0.757597743 -0.757597747 0.000000005 -3/9 Test #6: libgridxc_test_libxc ............. Passed 0.42 sec 1: 1: iSpin dens gradDens 1: 1 0.306353880 -0.680511824 -1.603721249 -1.510109275 @@ -2790,9 +2702,11 @@ 1: GGA PW91 0 2 Ex -0.931507400 -1.148656013 0.217148613 2 1: GGA PW91 0 3 Ex 0.064280832 -0.028020547 0.092301379 2 1: GGA PW91 0 4 Ex -0.017178700 0.256130816 0.273309515 2 +7: 1 6.200 0.000389881 -0.206110012 -0.206110014 0.000000001 1: GGA PBE 0 1 Ex -0.798153354 -0.570819275 0.227334079 2 1: GGA PBE 0 2 Ex -0.823875615 -1.051209698 0.227334083 2 1: GGA PBE 0 3 Ex 0.016890923 -0.084001793 0.100892716 2 +6: 1 8.000 0.000015954 -0.105308033 -0.105308040 0.000000007 1: GGA PBE 0 4 Ex -0.004514006 0.265667700 0.270181707 2 1: GGA RPBE 0 1 Ex -0.792709186 -0.504572833 0.288136353 2 1: GGA RPBE 0 2 Ex -0.946869196 -1.235005553 0.288136357 2 @@ -2812,10 +2726,12 @@ 1: GGA LYP 0 4 Ec -0.030116819 0.122490542 0.152607361 2 1: GGA WC 0 1 Ex -0.819366093 -0.655807855 0.163558238 2 1: GGA WC 0 2 Ex -0.795178791 -0.958737033 0.163558242 2 +6: 1 8.200 0.000010638 -0.093651613 -0.093651624 0.000000011 1: GGA WC 0 3 Ex -0.015882968 -0.091141627 0.075258659 2 1: GGA WC 0 4 Ex 0.004244636 0.188638573 0.184393937 2 1: GGA PBEJsJrLO 0 1 Ex -0.788502591 -0.602831538 0.185671053 2 1: GGA PBEJsJrLO 0 2 Ex -0.770841486 -0.956512543 0.185671057 2 +7: 1 6.400 0.000284517 -0.190918393 -0.190918393 -0.000000000 1: GGA PBEJsJrLO 0 3 Ex -0.011597440 -0.096159057 0.084561618 2 1: GGA PBEJsJrLO 0 4 Ex 0.003099352 0.215685596 0.212586244 2 1: GGA PBEJsJrHEG 0 1 Ex -0.806079406 -0.649690382 0.156389024 2 @@ -2825,6 +2741,7 @@ 1: GGA PBEGcGxLO 0 1 Ex -0.785803102 -0.622495992 0.163307109 2 1: GGA PBEGcGxLO 0 2 Ex -0.742105206 -0.905412318 0.163307113 2 1: GGA PBEGcGxLO 0 3 Ex -0.028694903 -0.104432293 0.075737391 2 +6: 1 8.400 0.000007022 -0.082649174 -0.082649186 0.000000012 1: GGA PBEGcGxLO 0 4 Ex 0.007668555 0.189555625 0.181887070 2 1: GGA PBEGcGxHEG 0 1 Ex -0.801787655 -0.660983539 0.140804116 2 1: GGA PBEGcGxHEG 0 2 Ex -0.754551580 -0.895355700 0.140804120 2 @@ -2840,6 +2757,8 @@ 1: GGA AM05 0 2 Ec -0.078512984 -0.074078581 0.004434403 2 1: GGA AM05 0 3 Ex -0.117804252 -0.175633304 0.057829051 2 1: GGA AM05 0 3 Ec 0.012857405 0.014743147 0.001885741 2 +7: 1 6.600 0.000205559 -0.178797194 -0.178797195 0.000000002 +6: 1 8.600 0.000004589 -0.072448262 -0.072448275 0.000000013 1: GGA AM05 0 4 Ex 0.031482540 0.113854917 0.082372377 2 1: GGA AM05 0 4 Ec -0.003436071 -0.009014159 0.005578088 2 1: GGA PW86 0 1 Ex -0.800726114 -0.567576322 0.233149792 2 @@ -2858,6 +2777,7 @@ 1: GGA BH 0 2 Ex -0.762743968 -0.939381693 0.176637725 2 1: GGA BH 0 3 Ex -0.006394034 -0.090517106 0.084123072 2 1: GGA BH 0 4 Ex 0.001708771 0.190198587 0.188489816 2 +6: 1 8.800 0.000002969 -0.063127570 -0.063127580 0.000000010 1: 1: iSpin dens gradDens 1: 1 0.112631681 -0.579288333 0.260381194 -0.058482778 @@ -2871,9 +2791,11 @@ 1: GGA PBE 0 1 Ex -0.547905131 -0.529467213 0.018437918 2 1: GGA PBE 0 2 Ex -0.455273691 -0.473711608 0.018437918 2 1: GGA PBE 0 3 Ex 0.066608806 0.119572555 0.052963748 2 +7: 1 6.800 0.000147033 -0.170379794 -0.170379797 0.000000004 1: GGA PBE 0 4 Ex 0.018098967 -0.129638022 0.147736989 2 1: GGA RPBE 0 1 Ex -0.526450949 -0.503770875 0.022680074 2 1: GGA RPBE 0 2 Ex -0.449379773 -0.472059848 0.022680074 2 +6: 1 9.000 0.000001902 -0.054712232 -0.054712227 -0.000000005 1: GGA RPBE 0 3 Ex 0.055419834 0.120572572 0.065152738 2 1: GGA RPBE 0 4 Ex 0.015058696 -0.166681091 0.181739787 2 1: GGA revPBE 0 1 Ex -0.554595369 -0.533045479 0.021549890 2 @@ -2891,7 +2813,9 @@ 1: GGA WC 0 1 Ex -0.570799523 -0.557798278 0.013001244 2 1: GGA WC 0 2 Ex -0.461631581 -0.474632825 0.013001244 2 1: GGA WC 0 3 Ex 0.078499765 0.115843757 0.037343991 2 +7: 1 7.000 0.000104122 -0.165839032 -0.165839041 0.000000008 1: GGA WC 0 4 Ex 0.021329983 -0.082834911 0.104164893 2 +6: 1 9.200 0.000001206 -0.047188843 -0.047188796 -0.000000047 1: GGA PBEJsJrLO 0 1 Ex -0.553829163 -0.539265158 0.014564004 2 1: GGA PBEJsJrLO 0 2 Ex -0.456865191 -0.471429195 0.014564004 2 1: GGA PBEJsJrLO 0 3 Ex 0.069724215 0.111558254 0.041834039 2 @@ -2905,9 +2829,11 @@ 1: GGA PBEGcGxLO 0 3 Ex 0.071982686 0.108163523 0.036180837 2 1: GGA PBEGcGxLO 0 4 Ex 0.019559160 -0.081361073 0.100920233 2 1: GGA PBEGcGxHEG 0 1 Ex -0.552385207 -0.541173394 0.011211813 2 +6: 1 9.400 0.000000757 -0.040518186 -0.040518098 -0.000000088 1: GGA PBEGcGxHEG 0 2 Ex -0.414719334 -0.425931148 0.011211813 2 1: GGA PBEGcGxHEG 0 3 Ex 0.098991870 0.131197708 0.032205838 2 1: GGA PBEGcGxHEG 0 4 Ex 0.026898104 -0.062936278 0.089834382 2 +7: 1 7.200 0.000072999 -0.163810071 -0.163810083 0.000000013 1: GGA PBESOL 0 1 Ex -0.558123501 -0.545527115 0.012596386 2 1: GGA PBESOL 0 2 Ex -0.458018722 -0.470615107 0.012596386 2 1: GGA PBESOL 0 3 Ex 0.071982686 0.108163523 0.036180837 2 @@ -2923,11 +2849,13 @@ 1: GGA PW86 0 1 Ex -0.624559053 -0.600478306 0.024080748 2 1: GGA PW86 0 2 Ex -0.706433791 -0.730514537 0.024080745 2 1: GGA PW86 0 3 Ex -0.058873948 0.003679287 0.062553235 2 +6: 1 9.600 0.000000470 -0.034645149 -0.034645055 -0.000000093 1: GGA PW86 0 4 Ex -0.015997249 -0.184585851 0.168588602 2 1: GGA B88 0 1 Ex -0.617801132 -0.571510457 0.046290675 2 1: GGA B88 0 2 Ex -0.691794755 -0.738085419 0.046290664 2 1: GGA B88 0 3 Ex -0.053206847 0.035434457 0.088641304 2 1: GGA B88 0 4 Ex -0.014457382 -0.222220963 0.207763580 2 +7: 1 7.400 0.000050669 -0.160866313 -0.160866325 0.000000012 1: GGA C09 0 1 Ex -0.579342870 -0.567801358 0.011541512 2 1: GGA C09 0 2 Ex -0.537678381 -0.549219892 0.011541511 2 1: GGA C09 0 3 Ex 0.029959826 0.063114966 0.033155140 2 @@ -2953,9 +2881,6 @@ 1: GGA RPBE 0 1 Ex -0.942609276 -1.101803819 0.159194542 2 1: GGA RPBE 0 2 Ex -1.401682797 -1.242488264 0.159194534 2 1: GGA RPBE 0 3 Ex -0.120615180 -0.475655509 0.355040329 2 -7: 2 2.400 0.015452834 -0.730277351 -0.730277355 0.000000003 -7: 2 2.600 0.013637077 -0.701421448 -0.701421450 0.000000002 -7: 2 2.800 0.011914930 -0.671294327 -0.671294326 -0.000000000 1: GGA RPBE 0 4 Ex 0.114459565 0.059573346 0.054886219 2 1: GGA revPBE 0 1 Ex -0.942160603 -1.064833100 0.122672496 2 1: GGA revPBE 0 2 Ex -1.255585785 -1.132913298 0.122672487 2 @@ -2982,6 +2907,11 @@ 1: GGA PBEJsJrHEG 0 3 Ex -0.021181521 -0.209773412 0.188591891 2 1: GGA PBEJsJrHEG 0 4 Ex 0.020100518 -0.029671102 0.049771621 2 1: GGA PBEGcGxLO 0 1 Ex -0.978470289 -1.048338511 0.069868223 2 +6: 1 9.800 0.000000289 -0.029506017 -0.029505927 -0.000000089 +6: 1 10.000 0.000000176 -0.025033604 -0.025033523 -0.000000081 +6: 1 10.200 0.000000106 -0.021160723 -0.021160649 -0.000000073 +7: 1 7.600 0.000034818 -0.153027998 -0.153027990 -0.000000007 +7: 1 7.800 0.000023687 -0.138670726 -0.138670683 -0.000000044 1: GGA PBEGcGxLO 0 2 Ex -1.079901972 -1.010033758 0.069868214 2 1: GGA PBEGcGxLO 0 3 Ex -0.026649764 -0.233150729 0.206500965 2 1: GGA PBEGcGxLO 0 4 Ex 0.025289689 -0.052203395 0.077493084 2 @@ -3112,8 +3042,6 @@ 1: GGA RPBE 0 1 Ex -0.969560969 -0.234464076 0.735096892 2 1: GGA RPBE 0 2 Ex -0.991801981 -1.726898881 0.735096900 2 1: GGA RPBE 0 3 Ex -0.009137558 0.341235147 0.350372705 2 -7: 2 3.000 0.010306678 -0.640127830 -0.640127830 -0.000000000 -7: 2 3.200 0.008826792 -0.608140908 -0.608140905 -0.000000003 1: GGA RPBE 0 4 Ex -0.078554283 -0.015246547 0.063307737 2 1: GGA revPBE 0 1 Ex -0.949092345 -0.260634551 0.688457794 2 1: GGA revPBE 0 2 Ex -0.962535126 -1.650992929 0.688457802 2 @@ -3162,6 +3090,67 @@ 1: GGA PW86 0 1 Ex -1.009305050 -0.174562394 0.834742656 2 1: GGA PW86 0 2 Ex -1.042767345 -1.877510010 0.834742664 2 1: GGA PW86 0 3 Ex -0.013747740 0.218974497 0.232722237 2 +6: 1 10.400 0.000000063 -0.017822436 -0.017822370 -0.000000066 +6: 1 10.600 0.000000037 -0.014957437 -0.014957386 -0.000000051 +6: 1 10.800 0.000000022 -0.012508831 -0.012508778 -0.000000053 +6: 1 11.000 0.000000013 -0.010424505 -0.010424499 -0.000000007 +6: 1 11.200 0.000000007 -0.008657220 -0.008657193 -0.000000027 +6: 1 11.400 0.000000004 -0.007164525 -0.007164525 0.000000001 +6: 1 11.600 0.000000002 -0.005908554 -0.005908556 0.000000001 +6: 1 11.800 0.000000001 -0.004855756 -0.004855768 0.000000012 +6: iSpin r dens Vxc dExc/dDens diff +6: 2 0.000 0.031746818 -0.920374352 +6: 2 0.200 0.031588480 -0.919313228 -0.919313201 -0.000000027 +6: 2 0.400 0.031118189 -0.916129853 -0.916129830 -0.000000023 +6: 2 0.600 0.030349878 -0.908537498 -0.908537537 0.000000039 +6: 2 0.800 0.029306007 -0.899875935 -0.899875905 -0.000000029 +6: 2 1.000 0.028016469 -0.887406482 -0.887406471 -0.000000011 +6: 2 1.200 0.026517171 -0.873372400 -0.873372388 -0.000000012 +6: 2 1.400 0.024848378 -0.856614633 -0.856614620 -0.000000012 +6: 2 1.600 0.023052921 -0.837890983 -0.837890986 0.000000003 +6: 2 1.800 0.021174391 -0.817154056 -0.817154060 0.000000004 +6: 2 2.000 0.019255418 -0.794632457 -0.794632455 -0.000000001 +6: 2 2.200 0.017336125 -0.770502247 -0.770502244 -0.000000003 +6: 2 2.400 0.015452834 -0.744951774 -0.744951771 -0.000000003 +6: 2 2.600 0.013637077 -0.718168689 -0.718168688 -0.000000001 +6: 2 2.800 0.011914930 -0.690336837 -0.690336838 0.000000001 +6: 2 3.000 0.010306678 -0.661632866 -0.661632866 -0.000000000 +6: 2 3.200 0.008826792 -0.632223061 -0.632223058 -0.000000003 +6: 2 3.400 0.007484177 -0.602259891 -0.602259891 -0.000000000 +6: 2 3.600 0.006282640 -0.571876952 -0.571876952 -0.000000000 +6: 2 3.800 0.005221523 -0.541180002 -0.541180001 -0.000000001 +6: 2 4.000 0.004296443 -0.510231603 -0.510231604 0.000000001 +6: 2 4.200 0.003500077 -0.479029886 -0.479029886 0.000000000 +6: 2 4.400 0.002822947 -0.447492103 -0.447492103 0.000000000 +6: 2 4.600 0.002254159 -0.415472518 -0.415472519 0.000000001 +7: 1 8.000 0.000015954 -0.119748941 -0.119748847 -0.000000094 +7: 1 8.200 0.000010638 -0.100010797 -0.100010654 -0.000000143 +7: 1 8.400 0.000007022 -0.082462504 -0.082462335 -0.000000169 +7: 1 8.600 0.000004589 -0.068350286 -0.068350135 -0.000000151 +7: 1 8.800 0.000002969 -0.057583471 -0.057583442 -0.000000030 +7: 1 9.000 0.000001902 -0.049506694 -0.049507028 0.000000334 +7: 1 9.200 0.000001206 -0.043402831 -0.043404135 0.000001304 +7: 1 9.400 0.000000757 -0.038686660 -0.038688834 0.000002175 +7: 1 9.600 0.000000470 -0.034934582 -0.034936830 0.000002248 +7: 1 9.800 0.000000289 -0.031858263 -0.031860487 0.000002224 +7: 1 10.000 0.000000176 -0.029267821 -0.029269965 0.000002144 +7: 1 10.200 0.000000106 -0.027039672 -0.027041720 0.000002048 +7: 1 10.400 0.000000063 -0.025092806 -0.025094749 0.000001943 +7: 1 10.600 0.000000037 -0.023372816 -0.023374647 0.000001831 +7: 1 10.800 0.000000022 -0.021841709 -0.021843441 0.000001733 +7: 1 11.000 0.000000013 -0.020471625 -0.020473272 0.000001647 +7: 1 11.200 0.000000007 -0.019241059 -0.019242611 0.000001551 +7: 1 11.400 0.000000004 -0.018132612 -0.018133954 0.000001342 +7: 1 11.600 0.000000002 -0.017131679 -0.017133099 0.000001420 +7: 1 11.800 0.000000001 -0.016225680 -0.016226796 0.000001116 +7: iSpin r dens Vxc dExc/dDens diff +7: 2 0.000 0.031746818 -0.900701729 +7: 2 0.200 0.031588480 -0.903820205 -0.903820034 -0.000000171 +7: 2 0.400 0.031118189 -0.913175632 -0.913175738 0.000000106 +7: 2 0.600 0.030349878 -0.898888840 -0.898888780 -0.000000059 +7: 2 0.800 0.029306007 -0.900387339 -0.900387336 -0.000000003 +7: 2 1.000 0.028016469 -0.881655824 -0.881655835 0.000000011 +7: 2 1.200 0.026517171 -0.869787130 -0.869787138 0.000000008 1: GGA PW86 0 4 Ex -0.118187364 -0.027088020 0.091099344 2 1: GGA B88 0 1 Ex -0.938698814 -0.352587406 0.586111409 2 1: GGA B88 0 2 Ex -0.940433850 -1.526545266 0.586111416 2 @@ -3285,7 +3274,6 @@ 1: GGA WC 0 4 Ex 0.001901862 -0.021724975 0.023626837 2 1: GGA PBEJsJrLO 0 1 Ex -0.175133968 -0.144689748 0.030444220 2 1: GGA PBEJsJrLO 0 2 Ex -0.177106531 -0.207550736 0.030444205 2 -7: 2 3.400 0.007484177 -0.575559240 -0.575559243 0.000000003 1: GGA PBEJsJrLO 0 3 Ex -0.000821904 -0.016564806 0.015742902 2 1: GGA PBEJsJrLO 0 4 Ex 0.001551598 -0.026139860 0.027691459 2 1: GGA PBEJsJrHEG 0 1 Ex -0.152819201 -0.138183602 0.014635599 2 @@ -3365,8 +3353,6 @@ 1: GGA PBEJsJrLO 0 1 Ex -0.150684906 -0.166694225 0.016009320 2 1: GGA PBEJsJrLO 0 2 Ex -0.148666411 -0.132657065 0.016009346 2 1: GGA PBEJsJrLO 0 3 Ex -0.002438358 0.010670565 0.013108923 2 -7: 2 3.600 0.006282640 -0.542620903 -0.542620903 0.000000000 -7: 2 3.800 0.005221523 -0.509578436 -0.509578435 -0.000000001 1: GGA PBEJsJrLO 0 4 Ex 0.000408976 0.039058950 0.038649974 2 1: GGA PBEJsJrHEG 0 1 Ex -0.138749439 -0.147164591 0.008415152 2 1: GGA PBEJsJrHEG 0 2 Ex -0.132065581 -0.123650405 0.008415176 2 @@ -3450,16 +3436,11 @@ 1: GGA PBEJsJrHEG 0 2 Ex -0.633111321 -0.692708229 0.059596908 2 1: GGA PBEJsJrHEG 0 3 Ex -0.002191838 0.093652693 0.095844532 2 1: GGA PBEJsJrHEG 0 4 Ex -0.004571423 -0.024725128 0.020153705 2 -7: 2 4.000 0.004296443 -0.476699712 -0.476699713 0.000000001 -7: 2 4.200 0.003500077 -0.444266875 -0.444266877 0.000000001 1: GGA PBEGcGxLO 0 1 Ex -0.647994359 -0.571931357 0.076063002 2 1: GGA PBEGcGxLO 0 2 Ex -0.615331897 -0.691394906 0.076063009 2 1: GGA PBEGcGxLO 0 3 Ex 0.018087269 0.142347119 0.124259850 2 1: GGA PBEGcGxLO 0 4 Ex 0.037723844 0.011074410 0.026649434 2 1: GGA PBEGcGxHEG 0 1 Ex -0.618891835 -0.560771051 0.058120784 2 -7: 2 4.400 0.002822947 -0.412572354 -0.412572352 -0.000000002 -7: 2 4.600 0.002254159 -0.381911080 -0.381911077 -0.000000003 -7: 2 4.800 0.001782061 -0.352568553 -0.352568554 0.000000002 1: GGA PBEGcGxHEG 0 2 Ex -0.620355704 -0.678476494 0.058120790 2 1: GGA PBEGcGxHEG 0 3 Ex -0.000810637 0.093044797 0.093855434 2 1: GGA PBEGcGxHEG 0 4 Ex -0.001690710 -0.021529746 0.019839036 2 @@ -3621,8 +3602,6 @@ 1: GGA PBEGcGxHEG 0 4 Ex 0.164046930 0.176826336 0.012779406 2 1: GGA PBESOL 0 1 Ex -1.066658168 -1.090099050 0.023440882 2 1: GGA PBESOL 0 2 Ex -1.118052047 -1.094611164 0.023440883 2 -7: 2 5.000 0.001394815 -0.324805491 -0.324805492 0.000000001 -7: 2 5.200 0.001080853 -0.298841517 -0.298841517 -0.000000000 1: GGA PBESOL 0 3 Ex 0.015561745 -0.030895839 0.046457584 2 1: GGA PBESOL 0 4 Ex 0.095603895 0.109466510 0.013862615 2 1: GGA AM05 0 1 Ex -0.980491534 -0.997255740 0.016764206 2 @@ -3631,9 +3610,6 @@ 1: GGA AM05 0 2 Ec -0.086658061 -0.087513113 0.000855052 2 1: GGA AM05 0 3 Ex 0.029218871 -0.062082369 0.091301240 2 1: GGA AM05 0 3 Ec -0.008123964 -0.006436873 0.001687091 2 -7: 2 5.400 0.000829225 -0.274842954 -0.274842954 -0.000000000 -7: 2 5.600 0.000629844 -0.252923338 -0.252923338 -0.000000000 -7: 2 5.800 0.000473640 -0.233169001 -0.233169001 -0.000000000 1: GGA AM05 0 4 Ex 0.179506720 0.198874084 0.019367364 2 1: GGA AM05 0 4 Ec -0.049909738 -0.050414177 0.000504439 2 1: GGA PW86 0 1 Ex -1.153882449 -1.201098507 0.047216058 2 @@ -3727,6 +3703,75 @@ 1: GGA C09 0 3 Ex 0.011681764 0.139540461 0.127858697 2 1: GGA C09 0 4 Ex -0.034616742 0.122652384 0.157269126 2 1: GGA BH 0 1 Ex -1.105824030 -1.234500979 0.128676949 2 +6: 2 4.800 0.001782061 -0.382860808 -0.382860807 -0.000000001 +6: 2 5.000 0.001394815 -0.349787495 -0.349787495 -0.000000000 +6: 2 5.200 0.001080853 -0.316870200 -0.316870199 -0.000000001 +6: 2 5.400 0.000829225 -0.285306984 -0.285306984 -0.000000000 +6: 2 5.600 0.000629844 -0.256619554 -0.256619554 -0.000000001 +6: 2 5.800 0.000473640 -0.232083909 -0.232083909 0.000000000 +6: 2 6.000 0.000352629 -0.212182116 -0.212182116 0.000000000 +6: 2 6.200 0.000259921 -0.196433380 -0.196433380 -0.000000000 +6: 2 6.400 0.000189678 -0.183672030 -0.183672031 0.000000000 +6: 2 6.600 0.000137039 -0.172541723 -0.172541727 0.000000003 +6: 2 6.800 0.000098022 -0.161917868 -0.161917872 0.000000004 +6: 2 7.000 0.000069415 -0.151110560 -0.151110564 0.000000004 +6: 2 7.200 0.000048666 -0.139861549 -0.139861554 0.000000005 +6: 2 7.400 0.000033779 -0.128226737 -0.128226743 0.000000006 +6: 2 7.600 0.000023212 -0.116433222 -0.116433229 0.000000007 +6: 2 7.800 0.000015792 -0.104762753 -0.104762762 0.000000009 +6: 2 8.000 0.000010636 -0.093477793 -0.093477805 0.000000012 +6: 2 8.200 0.000007092 -0.082785576 -0.082785590 0.000000014 +6: 2 8.400 0.000004681 -0.072828254 -0.072828270 0.000000016 +6: 2 8.600 0.000003059 -0.063687629 -0.063687643 0.000000014 +6: 2 8.800 0.000001979 -0.055396187 -0.055396188 0.000000001 +6: 2 9.000 0.000001268 -0.047949450 -0.047949418 -0.000000032 +6: 2 9.200 0.000000804 -0.041317198 -0.041317116 -0.000000082 +6: 2 9.400 0.000000504 -0.035452601 -0.035452510 -0.000000091 +6: 2 9.600 0.000000313 -0.030299188 -0.030299098 -0.000000090 +6: 2 9.800 0.000000193 -0.025795893 -0.025795813 -0.000000081 +6: 2 10.000 0.000000117 -0.021880577 -0.021880500 -0.000000077 +6: 2 10.200 0.000000071 -0.018492378 -0.018492313 -0.000000065 +6: 2 10.400 0.000000042 -0.015573224 -0.015573162 -0.000000061 +6: 2 10.600 0.000000025 -0.013068736 -0.013068683 -0.000000052 +6: 2 10.800 0.000000015 -0.010928714 -0.010928684 -0.000000030 +6: 2 11.000 0.000000008 -0.009107337 -0.009107286 -0.000000051 +6: 2 11.200 0.000000005 -0.007563161 -0.007563175 0.000000014 +6: 2 11.400 0.000000003 -0.006258998 -0.006258990 -0.000000008 +6: 2 11.600 0.000000002 -0.005161710 -0.005161565 -0.000000145 +6: avgDiffVxc, maxDiffVxc = 0.000000027 0.000000145 +7: 2 1.400 0.024848378 -0.849409711 -0.849409715 0.000000004 +7: 2 1.600 0.023052921 -0.829194760 -0.829194765 0.000000006 +7: 2 1.800 0.021174391 -0.806916840 -0.806916837 -0.000000003 +7: 2 2.000 0.019255418 -0.783153757 -0.783153759 0.000000001 +7: 2 2.200 0.017336125 -0.757597743 -0.757597747 0.000000005 +7: 2 2.400 0.015452834 -0.730277351 -0.730277355 0.000000003 +7: 2 2.600 0.013637077 -0.701421448 -0.701421450 0.000000002 +7: 2 2.800 0.011914930 -0.671294327 -0.671294326 -0.000000000 +7: 2 3.000 0.010306678 -0.640127830 -0.640127830 -0.000000000 +7: 2 3.200 0.008826792 -0.608140908 -0.608140905 -0.000000003 +7: 2 3.400 0.007484177 -0.575559240 -0.575559243 0.000000003 +7: 2 3.600 0.006282640 -0.542620903 -0.542620903 0.000000000 +7: 2 3.800 0.005221523 -0.509578436 -0.509578435 -0.000000001 +7: 2 4.000 0.004296443 -0.476699712 -0.476699713 0.000000001 +7: 2 4.200 0.003500077 -0.444266875 -0.444266877 0.000000001 +7: 2 4.400 0.002822947 -0.412572354 -0.412572352 -0.000000002 +7: 2 4.600 0.002254159 -0.381911080 -0.381911077 -0.000000003 +7: 2 4.800 0.001782061 -0.352568553 -0.352568554 0.000000002 +7: 2 5.000 0.001394815 -0.324805491 -0.324805492 0.000000001 +7: 2 5.200 0.001080853 -0.298841517 -0.298841517 -0.000000000 +7: 2 5.400 0.000829225 -0.274842954 -0.274842954 -0.000000000 +7: 2 5.600 0.000629844 -0.252923338 -0.252923338 -0.000000000 +7: 2 5.800 0.000473640 -0.233169001 -0.233169001 -0.000000000 +7: 2 6.000 0.000352629 -0.215702309 -0.215702310 0.000000001 +7: 2 6.200 0.000259921 -0.200780146 -0.200780147 0.000000001 +7: 2 6.400 0.000189678 -0.188871729 -0.188871731 0.000000002 +7: 2 6.600 0.000137039 -0.180551188 -0.180551191 0.000000003 +7: 2 6.800 0.000098022 -0.175955357 -0.175955367 0.000000010 +7: 2 7.000 0.000069415 -0.173810452 -0.173810467 0.000000015 +7: 2 7.200 0.000048666 -0.170894083 -0.170894097 0.000000014 +7: 2 7.400 0.000033779 -0.163293898 -0.163293895 -0.000000004 +7: 2 7.600 0.000023212 -0.149116243 -0.149116198 -0.000000045 +7: 2 7.800 0.000015792 -0.129929391 -0.129929289 -0.000000102 1: GGA BH 0 2 Ex -1.066137590 -0.937460645 0.128676945 2 1: GGA BH 0 3 Ex 0.007731750 0.135726719 0.127994969 2 1: GGA BH 0 4 Ex -0.022911608 0.131725735 0.154637343 2 @@ -3788,8 +3833,6 @@ 1: GGA AM05 0 1 Ec -0.107174657 -0.116444198 0.009269541 2 1: GGA AM05 0 2 Ex -1.390522842 -1.411445652 0.020922810 2 1: GGA AM05 0 2 Ec -0.069334428 -0.060064886 0.009269541 2 -7: 2 6.000 0.000352629 -0.215702309 -0.215702310 0.000000001 -7: 2 6.200 0.000259921 -0.200780146 -0.200780147 0.000000001 1: GGA AM05 0 3 Ex -0.098221535 0.036740665 0.134962200 2 1: GGA AM05 0 3 Ec 0.006857818 -0.014586824 0.021444642 2 1: GGA AM05 0 4 Ex 0.070957566 0.177872677 0.106915111 2 @@ -3870,9 +3913,6 @@ 1: GGA AM05 0 2 Ec -0.046623830 -0.046327993 0.000295837 2 1: GGA AM05 0 3 Ex 0.017052699 -0.124892826 0.141945525 2 1: GGA AM05 0 3 Ec -0.007156381 -0.006813200 0.000343181 2 -7: 2 6.400 0.000189678 -0.188871729 -0.188871731 0.000000002 -7: 2 6.600 0.000137039 -0.180551188 -0.180551191 0.000000003 -7: 2 6.800 0.000098022 -0.175955357 -0.175955367 0.000000010 1: GGA AM05 0 4 Ex 0.010945441 0.069097451 0.058152010 2 1: GGA AM05 0 4 Ec -0.004593393 -0.004932091 0.000338699 2 1: GGA PW86 0 1 Ex -0.541513776 -0.380577606 0.160936170 2 @@ -3949,9 +3989,6 @@ 1: GGA AM05 0 1 Ec -0.053704719 -0.054152921 0.000448202 2 1: GGA AM05 0 2 Ex -0.452136302 -0.524215851 0.072079549 2 1: GGA AM05 0 2 Ec -0.061733861 -0.061285659 0.000448202 2 -7: 2 7.000 0.000069415 -0.173810452 -0.173810467 0.000000015 -7: 2 7.200 0.000048666 -0.170894083 -0.170894097 0.000000014 -7: 2 7.400 0.000033779 -0.163293898 -0.163293895 -0.000000004 1: GGA AM05 0 3 Ex -0.017046783 -0.163660056 0.146613273 2 1: GGA AM05 0 3 Ec 0.001537334 0.013770726 0.012233392 2 1: GGA AM05 0 4 Ex -0.016871974 -0.058917319 0.042045345 2 @@ -4029,9 +4066,6 @@ 1: GGA AM05 0 3 Ex 0.000296876 3.293323876 3.293027001 2 1: GGA AM05 0 3 Ec 0.000020151 -0.000001681 0.000021832 2 1: GGA AM05 0 4 Ex 0.001013831 -3.706758954 3.707772785 2 -7: 2 7.600 0.000023212 -0.149116243 -0.149116198 -0.000000045 -7: 2 7.800 0.000015792 -0.129929391 -0.129929289 -0.000000102 -7: 2 8.000 0.000010636 -0.109368250 -0.109368094 -0.000000157 1: GGA AM05 0 4 Ec 0.000068815 0.000093593 0.000024779 2 1: GGA PW86 0 1 Ex -0.059871079 0.743936650 0.803807729 2 1: GGA PW86 0 2 Ex -0.061899493 -0.865707219 0.803807726 2 @@ -4119,8 +4153,6 @@ 1: GGA BH 0 1 Ex -0.309684071 -0.365716610 0.056032539 2 1: GGA BH 0 2 Ex -0.339323049 -0.283290503 0.056032547 2 1: GGA BH 0 3 Ex 0.014146237 0.006976704 0.007169533 2 -7: 2 8.200 0.000007092 -0.090658025 -0.090657833 -0.000000193 -7: 2 8.400 0.000004681 -0.075347142 -0.075346959 -0.000000183 1: GGA BH 0 4 Ex -0.028745457 -0.061160856 0.032415398 2 1: 1: iSpin dens gradDens @@ -4208,7 +4240,6 @@ 1: 4 0.287203168 0.194739712 2.777693808 9.826945331 1: GGA PW91 0 1 Ex -1.276559787 -1.092351453 0.184208334 2 1: GGA PW91 0 2 Ex -1.289278297 -1.473486616 0.184208319 2 -7: 2 8.600 0.000003059 -0.063522910 -0.063522832 -0.000000078 1: GGA PW91 0 3 Ex 0.004464320 0.692526836 0.688062516 2 1: GGA PW91 0 4 Ex -0.012796273 0.318797050 0.331593322 2 1: GGA PBE 0 1 Ex -1.305762718 -1.129665190 0.176097528 2 @@ -4292,9 +4323,6 @@ 1: GGA PBE 0 1 Ex -0.251681716 -0.250539257 0.001142458 2 1: GGA PBE 0 2 Ex -0.178782918 -0.179925398 0.001142480 2 1: GGA PBE 0 3 Ex 0.051328904 0.052159783 0.000830879 2 -7: 2 8.800 0.000001979 -0.054565736 -0.054565986 0.000000250 -7: 2 9.000 0.000001268 -0.047730494 -0.047731613 0.000001119 -7: 2 9.200 0.000000804 -0.042399692 -0.042401841 0.000002149 1: GGA PBE 0 4 Ex -0.003300546 -0.002995864 0.000304682 2 1: GGA RPBE 0 1 Ex -0.277159936 -0.277157509 0.000002427 2 1: GGA RPBE 0 2 Ex -0.185633377 -0.185635826 0.000002449 2 @@ -4372,8 +4400,6 @@ 1: GGA PBE 0 1 Ex -0.564882601 -0.530914427 0.033968174 2 1: GGA PBE 0 2 Ex -0.606063522 -0.640031676 0.033968154 2 1: GGA PBE 0 3 Ex 0.049000000 0.045920691 0.003079309 2 -7: 2 9.400 0.000000504 -0.038127408 -0.038129670 0.000002261 -7: 2 9.600 0.000000313 -0.034608838 -0.034611088 0.000002250 1: GGA PBE 0 4 Ex 0.007377503 -0.066974754 0.074352258 2 1: GGA RPBE 0 1 Ex -0.517220205 -0.474138392 0.043081813 2 1: GGA RPBE 0 2 Ex -0.566157295 -0.609239088 0.043081793 2 @@ -4461,9 +4487,6 @@ 1: GGA revPBE 0 2 Ex -0.176233315 -0.194418852 0.018185537 2 1: GGA revPBE 0 3 Ex -0.006260627 -0.034668850 0.028408223 2 1: GGA revPBE 0 4 Ex 0.007030889 -0.027149132 0.034180021 2 -7: 2 9.800 0.000000193 -0.031640567 -0.031642752 0.000002185 -7: 2 10.000 0.000000117 -0.029088011 -0.029090107 0.000002095 -7: 2 10.200 0.000000071 -0.026861487 -0.026863473 0.000001986 1: GGA LYP 0 1 Ex -0.145935873 -0.211462318 0.065526444 2 1: GGA LYP 0 1 Ec -0.379882610 -0.076094578 0.303788032 2 1: GGA LYP 0 2 Ex -0.125685929 -0.060159485 0.065526444 2 @@ -4532,6 +4555,7 @@ 1: GGA PW91 0 4 Ex 0.004092851 0.014751277 0.010658426 2 1: GGA PBE 0 1 Ex -0.228533484 -0.228305882 0.000227602 2 1: GGA PBE 0 2 Ex -0.204809531 -0.205037139 0.000227608 2 +3/9 Test #6: libgridxc_test_libxc ............. Passed 0.08 sec 1: GGA PBE 0 3 Ex -0.000268871 -0.000036708 0.000232163 2 1: GGA PBE 0 4 Ex -0.008325657 -0.008657448 0.000331791 2 1: GGA revPBE 0 1 Ex -0.279293907 -0.278743711 0.000550196 2 @@ -4550,9 +4574,6 @@ 1: GGA WC 0 2 Ex -0.203279465 -0.203645303 0.000365838 2 1: GGA WC 0 3 Ex -0.000268248 0.000010766 0.000279014 2 1: GGA WC 0 4 Ex -0.008306353 -0.008836600 0.000530247 2 -7: 2 10.400 0.000000042 -0.024899792 -0.024901679 0.000001887 -7: 2 10.600 0.000000025 -0.023159554 -0.023161332 0.000001778 -7: 2 10.800 0.000000015 -0.021608555 -0.021610227 0.000001672 1: GGA PBEJsJrLO 0 1 Ex -0.226554636 -0.226222263 0.000332373 2 1: GGA PBEJsJrLO 0 2 Ex -0.202634216 -0.202966595 0.000332379 2 1: GGA PBEJsJrLO 0 3 Ex -0.000271098 0.000059053 0.000330151 2 @@ -4600,12 +4621,15 @@ 1: 2 0.000000000 0.000000002 0.000000000 -0.000000001 1: 3 0.000000000 0.000000002 -0.000000001 -0.000000000 1: 4 0.000000000 0.000000002 -0.000000001 -0.000000002 +7: 2 8.000 0.000010636 -0.109368250 -0.109368094 -0.000000157 +7: 2 8.200 0.000007092 -0.090658025 -0.090657833 -0.000000193 +7: 2 8.400 0.000004681 -0.075347142 -0.075346959 -0.000000183 +7: 2 8.600 0.000003059 -0.063522910 -0.063522832 -0.000000078 1: GGA LYP 0 1 Ex 0.000000000 -0.004009514 0.004009514 2 1: GGA LYP 0 1 Ec -0.000399843 -0.001206934 0.000807091 2 1: GGA LYP 0 2 Ex 0.000000000 -0.004009514 0.004009514 2 1: GGA LYP 0 2 Ec -0.000399843 -0.001206934 0.000807091 2 -7: 2 11.000 0.000000008 -0.020221667 -0.020223270 0.000001603 -7: 2 11.200 0.000000005 -0.018978407 -0.018979872 0.000001465 +7: 2 8.800 0.000001979 -0.054565736 -0.054565986 0.000000250 1: GGA AM05 0 1 Ex -0.023038960 0.811771855 0.834810816 2 1: GGA AM05 0 2 Ex -0.022981484 -0.857792300 0.834810816 2 1: GGA AM05 0 3 Ex 0.000794355 0.319393863 0.318599507 2 @@ -4615,6 +4639,7 @@ 1: GGA PW86 0 3 Ex 0.000098873 0.014390068 0.014291195 2 1: GGA PW86 0 4 Ex 0.000046165 -0.027651072 0.027697237 2 1: GGA B88 0 1 Ex -0.030126586 1.579459239 1.609585825 2 +7: 2 9.000 0.000001268 -0.047730494 -0.047731613 0.000001119 1: GGA B88 0 2 Ex -0.030043534 -1.639630781 1.609587247 2 1: GGA B88 0 3 Ex 0.001147841 0.615551749 0.614403908 2 1: GGA B88 0 4 Ex 0.000535940 -1.190627776 1.191163716 2 @@ -4635,6 +4660,7 @@ 1: GGA PBE 0 1 Ex -1.443260027 -1.904030101 0.460770074 2 1: GGA PBE 0 2 Ex -1.470735067 -1.009964991 0.460770076 2 1: GGA PBE 0 3 Ex -0.009826971 -0.005475481 0.004351490 2 +7: 2 9.200 0.000000804 -0.042399692 -0.042401841 0.000002149 1: GGA PBE 0 4 Ex 0.027477248 0.259400095 0.231922847 2 1: GGA RPBE 0 1 Ex -1.318882341 -1.970122034 0.651239693 2 1: GGA RPBE 0 2 Ex -1.352282952 -0.701043257 0.651239695 2 @@ -4654,6 +4680,7 @@ 1: GGA LYP 0 4 Ec 0.014755021 -0.005753713 0.020508734 2 1: GGA WC 0 1 Ex -1.417300440 -1.843877026 0.426576585 2 1: GGA WC 0 2 Ex -1.365440720 -0.938864133 0.426576588 2 +7: 2 9.400 0.000000504 -0.038127408 -0.038129670 0.000002261 1: GGA WC 0 3 Ex 0.018548617 0.056067994 0.037519377 2 1: GGA WC 0 4 Ex -0.051863888 0.174825755 0.226689643 2 1: GGA PBEJsJrLO 0 1 Ex -1.403600971 -1.823898258 0.420297287 2 @@ -4669,16 +4696,13 @@ 1: GGA PBEGcGxLO 0 3 Ex 0.007508601 0.028954741 0.021446140 2 1: GGA PBEGcGxLO 0 4 Ex -0.020994839 0.181734499 0.202729338 2 1: GGA PBEGcGxHEG 0 1 Ex -1.455471068 -1.758801476 0.303330407 2 +7: 2 9.600 0.000000313 -0.034608838 -0.034611088 0.000002250 1: GGA PBEGcGxHEG 0 2 Ex -1.449531629 -1.146201219 0.303330409 2 1: GGA PBEGcGxHEG 0 3 Ex 0.002124354 0.010009538 0.007885184 2 -7: 2 11.400 0.000000003 -0.017861495 -0.017862944 0.000001448 -7: 2 11.600 0.000000002 -0.016855994 -0.016857324 0.000001330 -7: avgDiffVxc, maxDiffVxc = 0.000000680 0.000002261 1: GGA PBEGcGxHEG 0 4 Ex -0.005939917 0.148533205 0.154473122 2 1: GGA PBESOL 0 1 Ex -1.395490287 -1.785640210 0.390149924 2 1: GGA PBESOL 0 2 Ex -1.374497135 -0.984347210 0.390149926 2 1: GGA PBESOL 0 3 Ex 0.007508601 0.028954741 0.021446140 2 -4/9 Test #7: libgridxc_test_libxc2 ............ Passed 0.50 sec 1: GGA PBESOL 0 4 Ex -0.020994839 0.181734499 0.202729338 2 1: GGA AM05 0 1 Ex -1.339655204 -1.658427184 0.318771980 2 1: GGA AM05 0 1 Ec -0.079514682 -0.075837045 0.003677637 2 @@ -4691,6 +4715,7 @@ 1: GGA PW86 0 1 Ex -1.519180896 -1.957330777 0.438149881 2 1: GGA PW86 0 2 Ex -1.534581935 -1.096432052 0.438149883 2 1: GGA PW86 0 3 Ex -0.005508475 0.000957693 0.006466168 2 +7: 2 9.800 0.000000193 -0.031640567 -0.031642752 0.000002185 1: GGA PW86 0 4 Ex 0.015402277 0.236772232 0.221369955 2 1: GGA B88 0 1 Ex -1.361444390 -1.937654303 0.576209913 2 1: GGA B88 0 2 Ex -1.321613562 -0.745403646 0.576209916 2 @@ -4714,6 +4739,7 @@ 1: GGA PW91 0 2 Ex -0.549629975 -1.332965418 0.783335443 2 1: GGA PW91 0 3 Ex 0.044939069 6.752042798 6.707103729 2 1: GGA PW91 0 4 Ex 0.050322276 -3.585543079 3.635865355 2 +7: 2 10.000 0.000000117 -0.029088011 -0.029090107 0.000002095 1: GGA PBE 0 1 Ex -0.744042751 0.420429902 1.164472653 2 1: GGA PBE 0 2 Ex -0.564211126 -1.728683782 1.164472656 2 1: GGA PBE 0 3 Ex 0.026723153 8.699462794 8.672739641 2 @@ -4732,6 +4758,7 @@ 1: GGA LYP 0 2 Ec -0.019900213 0.415427508 0.435327721 2 1: GGA LYP 0 3 Ex 0.004278812 20.305362635 20.301083823 2 1: GGA LYP 0 3 Ec 0.040857633 -2.719234603 2.760092236 2 +7: 2 10.200 0.000000071 -0.026861487 -0.026863473 0.000001986 1: GGA LYP 0 4 Ex 0.004791366 -8.974863869 8.979655236 2 1: GGA LYP 0 4 Ec 0.045751929 1.202521807 1.156769878 2 1: GGA WC 0 1 Ex -0.700448930 0.638931703 1.339380632 2 @@ -4747,6 +4774,7 @@ 1: GGA PBEJsJrHEG 0 3 Ex 0.018476462 5.966988711 5.948512249 2 1: GGA PBEJsJrHEG 0 4 Ex 0.020689739 -2.892234236 2.912923975 2 1: GGA PBEGcGxLO 0 1 Ex -0.650187710 0.661495647 1.311683357 2 +7: 2 10.400 0.000000042 -0.024899792 -0.024901679 0.000001887 1: GGA PBEGcGxLO 0 2 Ex -0.514858134 -1.826541494 1.311683360 2 1: GGA PBEGcGxLO 0 3 Ex 0.020110106 9.399587164 9.379477058 2 1: GGA PBEGcGxLO 0 4 Ex 0.022519076 -4.412276084 4.434795160 2 @@ -4762,6 +4790,7 @@ 1: GGA AM05 0 1 Ec -0.053664064 -0.062379197 0.008715133 2 1: GGA AM05 0 2 Ex -0.459260243 -2.431508548 1.972248305 2 1: GGA AM05 0 2 Ec -0.056084232 -0.047369099 0.008715133 2 +7: 2 10.600 0.000000025 -0.023159554 -0.023161332 0.000001778 1: GGA AM05 0 3 Ex -0.000774662 13.006759704 13.007534366 2 1: GGA AM05 0 3 Ec -0.000359639 -0.070913214 0.070553575 2 1: GGA AM05 0 4 Ex -0.000867458 -5.690760215 5.689892757 2 @@ -4782,6 +4811,7 @@ 1: GGA BH 0 2 Ex -0.388475507 -2.420042591 2.031567084 2 1: GGA BH 0 3 Ex 0.042311593 15.063289382 15.020977789 2 1: GGA BH 0 4 Ex 0.047380058 -7.262328537 7.309708595 2 +7: 2 10.800 0.000000015 -0.021608555 -0.021610227 0.000001672 1: 1: iSpin dens gradDens 1: 1 0.747633219 -2.289390578 9.258229308 -1.766202917 @@ -4801,6 +4831,7 @@ 1: GGA RPBE 0 3 Ex 0.202839184 0.034274513 0.168564671 2 1: GGA RPBE 0 4 Ex -0.147230465 -0.325382211 0.178151746 2 1: GGA revPBE 0 1 Ex -1.445357174 -1.526773747 0.081416572 2 +7: 2 11.000 0.000000008 -0.020221667 -0.020223270 0.000001603 1: GGA revPBE 0 2 Ex -1.221642846 -1.140226273 0.081416573 2 1: GGA revPBE 0 3 Ex 0.108185889 -0.077630517 0.185816406 2 1: GGA revPBE 0 4 Ex -0.078526537 -0.218551628 0.140025092 2 @@ -4833,6 +4864,7 @@ 1: GGA PBEGcGxHEG 0 3 Ex 0.008263551 -0.080469798 0.088733349 2 1: GGA PBEGcGxHEG 0 4 Ex -0.005998084 -0.078973956 0.072975872 2 1: GGA PBESOL 0 1 Ex -1.290955652 -1.344618578 0.053662926 2 +7: 2 11.200 0.000000005 -0.018978407 -0.018979872 0.000001465 1: GGA PBESOL 0 2 Ex -1.248846892 -1.195183965 0.053662927 2 1: GGA PBESOL 0 3 Ex 0.020363352 -0.093865927 0.114229280 2 1: GGA PBESOL 0 4 Ex -0.014780703 -0.095714018 0.080933314 2 @@ -4856,6 +4888,7 @@ 1: GGA C09 0 2 Ex -1.160065253 -1.044159242 0.115906011 2 1: GGA C09 0 3 Ex -0.046875095 -0.203118755 0.156243660 2 1: GGA C09 0 4 Ex 0.034024205 -0.016130060 0.050154265 2 +7: 2 11.400 0.000000003 -0.017861495 -0.017862944 0.000001448 1: GGA BH 0 1 Ex -1.305890082 -1.382037888 0.076147806 2 1: GGA BH 0 2 Ex -1.173362822 -1.097215015 0.076147807 2 1: GGA BH 0 3 Ex 0.064088785 -0.084036497 0.148125282 2 @@ -4910,6 +4943,8 @@ 1: GGA PBEGcGxHEG 0 2 Ex -0.290186190 -0.289466187 0.000720003 2 1: GGA PBEGcGxHEG 0 3 Ex 0.045321543 0.039765006 0.005556537 2 1: GGA PBEGcGxHEG 0 4 Ex 0.018964778 0.031735359 0.012770581 2 +7: 2 11.600 0.000000002 -0.016855994 -0.016857324 0.000001330 +7: avgDiffVxc, maxDiffVxc = 0.000000680 0.000002261 1: GGA PBESOL 0 1 Ex -0.347729282 -0.349119615 0.001390333 2 1: GGA PBESOL 0 2 Ex -0.324736245 -0.323345905 0.001390339 2 1: GGA PBESOL 0 3 Ex 0.038915909 0.028153874 0.010762035 2 @@ -4922,6 +4957,7 @@ 1: GGA AM05 0 3 Ec -0.012462025 -0.012429431 0.000032594 2 1: GGA AM05 0 4 Ex -0.006179027 0.075261413 0.081440440 2 1: GGA AM05 0 4 Ec -0.005214729 -0.005289669 0.000074940 2 +4/9 Test #7: libgridxc_test_libxc2 ............ Passed 0.09 sec 1: GGA PW86 0 1 Ex -0.351966084 -0.348600767 0.003365317 2 1: GGA PW86 0 2 Ex -0.353773124 -0.357138438 0.003365314 2 1: GGA PW86 0 3 Ex -0.003058431 -0.027497868 0.024439438 2 @@ -5948,6 +5984,7 @@ 1: GGA C09 0 2 Ex -1.424123322 -1.505563955 0.081440634 2 1: GGA C09 0 3 Ex -0.011768983 -0.027547716 0.015778733 2 1: GGA C09 0 4 Ex -0.067353589 -0.051676061 0.015677528 2 +5/9 Test #5: libgridxc_test6 .................. Passed 0.11 sec 1: GGA BH 0 1 Ex -1.246237729 -1.146007005 0.100230724 2 1: GGA BH 0 2 Ex -1.218560337 -1.318791057 0.100230721 2 1: GGA BH 0 3 Ex 0.015241821 -0.010482324 0.025724145 2 @@ -6344,7 +6381,6 @@ 1: GGA BH 0 2 Ex -0.325997569 -0.237939666 0.088057903 2 1: GGA BH 0 3 Ex 0.007253394 -0.109443923 0.116697316 2 1: GGA BH 0 4 Ex -0.003285315 -0.122385816 0.119100501 2 -5/9 Test #5: libgridxc_test6 .................. Passed 0.62 sec 1: 1: iSpin dens gradDens 1: 1 0.965263089 -2.249751961 2.801976386 3.174016176 @@ -9460,16 +9496,7 @@ 1: error 1 => V=dE/dDens is positive 1: error 2 => analytical and numerical value of dE/dDens differ 1: error 3 => analytical and numerical value of dE/dGradDens differ -6/9 Test #1: libgridxc_test1 .................. Passed 0.84 sec -3: Ex, Ec = -3.716289981 -0.771674483 -3: Dx, Dc = 1.192543612 0.121155159 -3: i1 i2 i3 iSpin Vxc dExc/dDens diff -3: 2 8 13 2 -0.313847006 -0.313847001 -0.000000004 -3: 4 2 23 2 -0.524218962 -0.524218971 0.000000009 -3: 5 6 2 1 -0.626312320 -0.626312307 -0.000000013 -3: 4 2 9 2 -0.561691010 -0.561691012 0.000000002 -3: 7 3 21 1 -0.491741169 -0.491741166 -0.000000003 -3: 1 2 0 2 -0.680189858 -0.680189865 0.000000007 +6/9 Test #1: libgridxc_test1 .................. Passed 0.20 sec 2: 2: funcs= VDW 2: auths= BH @@ -9480,6 +9507,8 @@ 2: 1 0.400 0.046677283 -0.999006885 -0.998709392 -0.000297492 2: 1 0.600 0.045524817 -0.987412253 -0.987508028 0.000095775 2: 1 0.800 0.043959010 -0.980158453 -0.980143421 -0.000015032 +3: Ex, Ec = -3.716289981 -0.771674483 +3: Dx, Dc = 1.192543612 0.121155159 2: 1 1.000 0.042024703 -0.963929151 -0.963927487 -0.000001664 2: 1 1.200 0.039775757 -0.949006509 -0.949005827 -0.000000683 2: 1 1.400 0.037272568 -0.929353368 -0.929356367 0.000002999 @@ -9487,29 +9516,35 @@ 2: 1 1.800 0.031761587 -0.884442948 -0.884442166 -0.000000782 2: 1 2.000 0.028883127 -0.858808538 -0.858809376 0.000000838 2: 1 2.200 0.026004187 -0.831341143 -0.831341120 -0.000000023 +3: i1 i2 i3 iSpin Vxc dExc/dDens diff +3: 2 8 13 2 -0.313847006 -0.313847001 -0.000000004 2: 1 2.400 0.023179251 -0.802320622 -0.802320401 -0.000000221 2: 1 2.600 0.020455616 -0.772056571 -0.772056929 0.000000357 2: 1 2.800 0.017872394 -0.740675199 -0.740674876 -0.000000323 2: 1 3.000 0.015460016 -0.708430779 -0.708429556 -0.000001223 2: 1 3.200 0.013240188 -0.675669578 -0.675674009 0.000004432 2: 1 3.400 0.011226266 -0.642459702 -0.642454690 -0.000005012 +3: 4 2 23 2 -0.524218962 -0.524218971 0.000000009 2: 1 3.600 0.009423960 -0.609091304 -0.609092447 0.000001143 2: 1 3.800 0.007832284 -0.575839731 -0.575841528 0.000001796 2: 1 4.000 0.006444664 -0.542697531 -0.542696460 -0.000001071 2: 1 4.200 0.005250115 -0.510078329 -0.510077514 -0.000000815 2: 1 4.400 0.004234421 -0.478003232 -0.478007539 0.000004307 +3: 5 6 2 1 -0.626312320 -0.626312307 -0.000000013 2: 1 4.600 0.003381238 -0.446577649 -0.446566564 -0.000011085 2: 1 4.800 0.002673091 -0.416186718 -0.416202731 0.000016013 2: 1 5.000 0.002092223 -0.386734472 -0.386724841 -0.000009631 2: 1 5.200 0.001621280 -0.359258071 -0.359253815 -0.000004256 2: 1 5.400 0.001243837 -0.329009264 -0.329019031 0.000009767 2: 1 5.600 0.000944766 -0.268263860 -0.268258609 -0.000005251 +3: 4 2 9 2 -0.561691010 -0.561691012 0.000000002 2: 1 5.800 0.000710460 -0.184072378 -0.184073423 0.000001045 2: 1 6.000 0.000528944 -0.147193854 -0.147194457 0.000000603 2: 1 6.200 0.000389881 -0.169127143 -0.169125286 -0.000001857 2: 1 6.400 0.000284517 -0.195915387 -0.195917508 0.000002121 2: 1 6.600 0.000205559 -0.203472102 -0.203471426 -0.000000676 2: 1 6.800 0.000147033 -0.198598658 -0.198597592 -0.000001066 +3: 7 3 21 1 -0.491741169 -0.491741166 -0.000000003 2: 1 7.000 0.000104122 -0.189565923 -0.189567430 0.000001507 2: 1 7.200 0.000072999 -0.181016372 -0.181015280 -0.000001093 2: 1 7.400 0.000050669 -0.173604245 -0.173604994 0.000000748 @@ -9517,6 +9552,7 @@ 2: 1 7.800 0.000023687 -0.155572229 -0.155573540 0.000001311 2: 1 8.000 0.000015954 -0.142174017 -0.142175066 0.000001050 2: 1 8.200 0.000010638 -0.126477393 -0.126473509 -0.000003883 +3: 1 2 0 2 -0.680189858 -0.680189865 0.000000007 2: 1 8.400 0.000007022 -0.110553043 -0.110555103 0.000002060 2: 1 8.600 0.000004589 -0.096226748 -0.096227608 0.000000861 2: 1 8.800 0.000002969 -0.084195519 -0.084194595 -0.000000924 @@ -9596,7 +9632,7 @@ 2: 2 11.400 0.000000003 -0.018968230 -0.018969162 0.000000932 2: 2 11.600 0.000000002 -0.016816386 -0.016817171 0.000000786 2: avgDiffVxc, maxDiffVxc = 0.000088744 0.000834790 -7/9 Test #2: libgridxc_test2 .................. Passed 28.22 sec +7/9 Test #2: libgridxc_test2 .................. Passed 10.67 sec 4: 4: funcs= VDW 4: auths= BH @@ -9607,7 +9643,7 @@ 4: atomDx, cellDx, diff = 1.349799036 1.349797201 0.000001835 4: atomDc, cellDc, diff = 0.155982425 0.155866069 0.000116356 4: avgDiffVxc, maxDiffVxc = 0.000006161 0.038047291 -8/9 Test #4: libgridxc_test4 .................. Passed 29.83 sec +8/9 Test #4: libgridxc_test4 .................. Passed 11.47 sec 3: xc stress * volume = 3: -4.405894836 -0.011039400 0.003122993 3: -0.011039400 -4.442866097 0.004079677 @@ -9620,11 +9656,11 @@ 3: 0.000022309 -0.000006705 0.000059142 3: -0.000006704 0.000002015 -0.000017774 3: 0.000059142 -0.000017774 0.000156789 -9/9 Test #3: libgridxc_test3 .................. Passed 32.16 sec +9/9 Test #3: libgridxc_test3 .................. Passed 15.53 sec 100% tests passed, 0 tests failed out of 9 -Total Test time (real) = 32.17 sec +Total Test time (real) = 15.56 sec make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' create-stamp debian/debhelper-build-stamp fakeroot debian/rules binary @@ -9632,7 +9668,7 @@ dh_testroot -O--buildsystem=cmake dh_prep -O--buildsystem=cmake dh_auto_install --destdir=debian/libgridxc-dev/ -O--buildsystem=cmake - cd obj-i686-linux-gnu && make -j11 install DESTDIR=/build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev AM_UPDATE_INFO_DIR=no "INSTALL=install --strip-program=true" + cd obj-i686-linux-gnu && make -j21 install DESTDIR=/build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev AM_UPDATE_INFO_DIR=no "INSTALL=install --strip-program=true" make[1]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' /usr/bin/cmake -S/build/reproducible-path/libgridxc-2.0.2 -B/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/CMakeFiles /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu//CMakeFiles/progress.marks @@ -9649,85 +9685,85 @@ [ 64%] Built target libgridxc-lib make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/depend make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/depend -make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/depend -make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/depend -make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/depend -make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/depend -make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend -make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/depend -make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake "--color=" +make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/depend +make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/depend cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/DependInfo.cmake "--color=" +make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/DependInfo.cmake "--color=" +make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake "--color=" +make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/depend +make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake "--color=" -make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake "--color=" +make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +cd /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.0.2 /build/reproducible-path/libgridxc-2.0.2/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake "--color=" make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/build +make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/build -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/build -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test2.dir/build'. -make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test6.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/build +make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/build +make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/build +make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/build make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/build +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/build +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/build +make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test1.dir/build'. +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test4.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc2.dir/build'. +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test1.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test4.dir/build'. +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test2.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +[ 68%] Built target libgridxc-test6 make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test3.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_hse06.dir/build'. +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test6.dir/build'. +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc2.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc.dir/build'. +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_match.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' +[ 72%] Built target libgridxc-test4 +[ 76%] Built target libgridxc-test1 +[ 80%] Built target libgridxc-test2 +[ 84%] Built target libgridxc-test_libxc2 +[ 88%] Built target libgridxc-test3 +[ 92%] Built target libgridxc-test_libxc +[ 96%] Built target libgridxc-test_match make[3]: Entering directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_match.dir/build'. +make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_hse06.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' -[ 68%] Built target libgridxc-test2 -[ 72%] Built target libgridxc-test1 -[ 80%] Built target libgridxc-test3 -[ 78%] Built target libgridxc-test_libxc2 -[ 98%] Built target libgridxc-test_hse06 -[ 98%] Built target libgridxc-test4 -[ 98%] Built target libgridxc-test6 -[100%] Built target libgridxc-test_libxc -[100%] Built target libgridxc-test_match +[100%] Built target libgridxc-test_hse06 make[2]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu/CMakeFiles 0 make -f CMakeFiles/Makefile2 preinstall @@ -9744,40 +9780,40 @@ -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/lib/i386-linux-gnu/cmake/libgridxc/libgridxc-targets.cmake -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/lib/i386-linux-gnu/cmake/libgridxc/libgridxc-targets-relwithdebinfo.cmake -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0 --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gga.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_alloc.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_am05.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh1d.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh3d.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_bessph.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_config.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_atom.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cellsubs.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gpfa_core_dp.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fftr.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_sys.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_vdwxc.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gga.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_minvec.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_hybrids.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_sorting.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_xcmod.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_radfft.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_array.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_io.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_walltime.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_debugxc.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_vv_vdwxc.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_interpolation.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gpfa_core_dp.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cell.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gpfa_core_sp.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cell.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_xwpbe.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_atom.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_precision.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_alloc.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_chkgmx.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fft_gpfa.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cellsubs.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_xcmod.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_minvec.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_moreparallelsubs.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_chkgmx.mod --- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_lda.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_interpolation.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_am05.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_vdwxc.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_debugxc.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_vv_vdwxc.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fft3d.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_precision.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh3d.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_xwpbe.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_sys.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_array.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_walltime.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_lda.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_io.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_sorting.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh1d.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_bessph.mod +-- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_config.mod -- Installing: /build/reproducible-path/libgridxc-2.0.2/debian/libgridxc-dev/usr/share/licenses/libgridxc/COPYING make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.0.2/obj-i686-linux-gnu' dh_installdocs -O--buildsystem=cmake @@ -9807,12 +9843,14 @@ dpkg-buildpackage: info: binary-only upload (no source included) dpkg-genchanges: info: including full source code in upload I: copying local configuration +I: user script /srv/workspace/pbuilder/25046/tmp/hooks/B01_cleanup starting +I: user script /srv/workspace/pbuilder/25046/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/30440 and its subdirectories -I: Current time: Tue Dec 31 03:31:19 -12 2024 -I: pbuilder-time-stamp: 1735659079 +I: removing directory /srv/workspace/pbuilder/25046 and its subdirectories +I: Current time: Tue Feb 3 11:57:26 +14 2026 +I: pbuilder-time-stamp: 1770069446