I: pbuilder: network access will be disabled during build I: Current time: Sun Mar 9 17:16:40 -12 2025 I: pbuilder-time-stamp: 1741583800 I: Building the build Environment I: extracting base tarball [/var/cache/pbuilder/unstable-reproducible-base.tgz] I: copying local configuration W: --override-config is not set; not updating apt.conf Read the manpage for details. I: mounting /proc filesystem I: mounting /sys filesystem I: creating /{dev,run}/shm I: mounting /dev/pts filesystem I: redirecting /dev/ptmx to /dev/pts/ptmx I: policy-rc.d already exists I: Copying source file I: copying [libgridxc_2.1.0-1.dsc] I: copying [./libgridxc_2.1.0.orig.tar.bz2] I: copying [./libgridxc_2.1.0-1.debian.tar.xz] I: Extracting source dpkg-source: warning: cannot verify inline signature for ./libgridxc_2.1.0-1.dsc: unsupported subcommand dpkg-source: info: extracting libgridxc in libgridxc-2.1.0 dpkg-source: info: unpacking libgridxc_2.1.0.orig.tar.bz2 dpkg-source: info: unpacking libgridxc_2.1.0-1.debian.tar.xz I: using fakeroot in build. I: Installing the build-deps I: user script /srv/workspace/pbuilder/3718922/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='arm64' DEBIAN_FRONTEND='noninteractive' DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all parallel=12 ' DISTRIBUTION='unstable' HOME='/root' HOST_ARCH='arm64' IFS=' ' INVOCATION_ID='673fdeb4e1a445caa869a04fa915f4c6' LANG='C' LANGUAGE='en_US:en' LC_ALL='C' 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='3718922' PS1='# ' PS2='> ' 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.5Lk8WVzu/pbuilderrc_t4cq --distribution unstable --hookdir /etc/pbuilder/first-build-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/unstable-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/r-b-build.5Lk8WVzu/b1 --logfile b1/build.log libgridxc_2.1.0-1.dsc' SUDO_GID='109' SUDO_UID='104' SUDO_USER='jenkins' TERM='unknown' TZ='/usr/share/zoneinfo/Etc/GMT+12' USER='root' _='/usr/bin/systemd-run' http_proxy='http://192.168.101.4:3128' I: uname -a Linux codethink04-arm64 6.1.0-31-cloud-arm64 #1 SMP Debian 6.1.128-1 (2025-02-07) aarch64 GNU/Linux I: ls -l /bin lrwxrwxrwx 1 root root 7 Mar 4 11:20 /bin -> usr/bin I: user script /srv/workspace/pbuilder/3718922/tmp/hooks/D02_print_environment finished -> Attempting to satisfy build-dependencies -> Creating pbuilder-satisfydepends-dummy package Package: pbuilder-satisfydepends-dummy Version: 0.invalid.0 Architecture: arm64 Maintainer: Debian Pbuilder Team Description: Dummy package to satisfy dependencies with aptitude - created by pbuilder This package was created automatically by pbuilder to satisfy the build-dependencies of the package being currently built. Depends: cmake, debhelper-compat (= 12), gfortran, libxc-dev, pkg-config dpkg-deb: building package 'pbuilder-satisfydepends-dummy' in '/tmp/satisfydepends-aptitude/pbuilder-satisfydepends-dummy.deb'. Selecting previously unselected package pbuilder-satisfydepends-dummy. (Reading database ... 19897 files and directories currently installed.) Preparing to unpack .../pbuilder-satisfydepends-dummy.deb ... Unpacking pbuilder-satisfydepends-dummy (0.invalid.0) ... dpkg: pbuilder-satisfydepends-dummy: dependency problems, but configuring anyway as you requested: pbuilder-satisfydepends-dummy depends on cmake; however: Package cmake is not installed. pbuilder-satisfydepends-dummy depends on debhelper-compat (= 12); however: Package debhelper-compat is not installed. pbuilder-satisfydepends-dummy depends on gfortran; however: Package gfortran is not installed. pbuilder-satisfydepends-dummy depends on libxc-dev; however: Package libxc-dev is not installed. pbuilder-satisfydepends-dummy depends on pkg-config; however: Package pkg-config is not installed. Setting up pbuilder-satisfydepends-dummy (0.invalid.0) ... Reading package lists... Building dependency tree... Reading state information... Initializing package states... Writing extended state information... Building tag database... pbuilder-satisfydepends-dummy is already installed at the requested version (0.invalid.0) pbuilder-satisfydepends-dummy is already installed at the requested version (0.invalid.0) The following NEW packages will be installed: autoconf{a} automake{a} autopoint{a} autotools-dev{a} bsdextrautils{a} cmake{a} cmake-data{a} debhelper{a} dh-autoreconf{a} dh-strip-nondeterminism{a} dwz{a} file{a} gettext{a} gettext-base{a} gfortran{a} gfortran-14{a} gfortran-14-aarch64-linux-gnu{a} gfortran-aarch64-linux-gnu{a} groff-base{a} intltool-debian{a} libarchive-zip-perl{a} libarchive13t64{a} libbrotli1{a} libcom-err2{a} libcurl4t64{a} libdebhelper-perl{a} libelf1t64{a} libexpat1{a} libffi8{a} libfile-stripnondeterminism-perl{a} libgfortran-14-dev{a} libgfortran5{a} libgnutls30t64{a} libgssapi-krb5-2{a} libicu72{a} libidn2-0{a} libjsoncpp26{a} libk5crypto3{a} libkeyutils1{a} libkrb5-3{a} libkrb5support0{a} libldap2{a} libmagic-mgc{a} libmagic1t64{a} libnghttp2-14{a} libnghttp3-9{a} libp11-kit0{a} libpipeline1{a} libpkgconf3{a} libproc2-0{a} libpsl5t64{a} librhash1{a} librtmp1{a} libsasl2-2{a} libsasl2-modules-db{a} libssh2-1t64{a} libtasn1-6{a} libtool{a} libuchardet0{a} libunistring5{a} libuv1t64{a} libxc-dev{a} libxc9{a} libxml2{a} m4{a} man-db{a} pkg-config{a} pkgconf{a} pkgconf-bin{a} po-debconf{a} procps{a} sensible-utils{a} The following packages are RECOMMENDED but will NOT be installed: ca-certificates curl krb5-locales libarchive-cpio-perl libldap-common libltdl-dev libmail-sendmail-perl libsasl2-modules linux-sysctl-defaults lynx psmisc publicsuffix wget 0 packages upgraded, 72 newly installed, 0 to remove and 0 not upgraded. Need to get 59.6 MB of archives. After unpacking 216 MB will be used. Writing extended state information... Get: 1 http://deb.debian.org/debian unstable/main arm64 libproc2-0 arm64 2:4.0.4-7 [62.4 kB] Get: 2 http://deb.debian.org/debian unstable/main arm64 procps arm64 2:4.0.4-7 [868 kB] Get: 3 http://deb.debian.org/debian unstable/main arm64 sensible-utils all 0.0.24 [24.8 kB] Get: 4 http://deb.debian.org/debian unstable/main arm64 libmagic-mgc arm64 1:5.45-3+b1 [314 kB] Get: 5 http://deb.debian.org/debian unstable/main arm64 libmagic1t64 arm64 1:5.45-3+b1 [102 kB] Get: 6 http://deb.debian.org/debian unstable/main arm64 file arm64 1:5.45-3+b1 [43.4 kB] Get: 7 http://deb.debian.org/debian unstable/main arm64 gettext-base arm64 0.23.1-1 [241 kB] Get: 8 http://deb.debian.org/debian unstable/main arm64 libuchardet0 arm64 0.0.8-1+b2 [69.2 kB] Get: 9 http://deb.debian.org/debian unstable/main arm64 groff-base arm64 1.23.0-7 [1129 kB] Get: 10 http://deb.debian.org/debian unstable/main arm64 bsdextrautils arm64 2.40.4-5 [92.0 kB] Get: 11 http://deb.debian.org/debian unstable/main arm64 libpipeline1 arm64 1.5.8-1 [40.2 kB] Get: 12 http://deb.debian.org/debian unstable/main arm64 man-db arm64 2.13.0-1 [1404 kB] Get: 13 http://deb.debian.org/debian unstable/main arm64 m4 arm64 1.4.19-7 [285 kB] Get: 14 http://deb.debian.org/debian unstable/main arm64 autoconf all 2.72-3 [493 kB] Get: 15 http://deb.debian.org/debian unstable/main arm64 autotools-dev all 20220109.1 [51.6 kB] Get: 16 http://deb.debian.org/debian unstable/main arm64 automake all 1:1.17-3 [862 kB] Get: 17 http://deb.debian.org/debian unstable/main arm64 autopoint all 0.23.1-1 [770 kB] Get: 18 http://deb.debian.org/debian unstable/main arm64 cmake-data all 3.31.6-1 [2268 kB] Get: 19 http://deb.debian.org/debian unstable/main arm64 libicu72 arm64 72.1-6 [9239 kB] Get: 20 http://deb.debian.org/debian unstable/main arm64 libxml2 arm64 2.12.7+dfsg+really2.9.14-0.2+b2 [630 kB] Get: 21 http://deb.debian.org/debian unstable/main arm64 libarchive13t64 arm64 3.7.4-1.1 [323 kB] Get: 22 http://deb.debian.org/debian unstable/main arm64 libbrotli1 arm64 1.1.0-2+b7 [308 kB] Get: 23 http://deb.debian.org/debian unstable/main arm64 libkrb5support0 arm64 1.21.3-4 [32.2 kB] Get: 24 http://deb.debian.org/debian unstable/main arm64 libcom-err2 arm64 1.47.2-1 [23.9 kB] Get: 25 http://deb.debian.org/debian unstable/main arm64 libk5crypto3 arm64 1.21.3-4 [81.5 kB] Get: 26 http://deb.debian.org/debian unstable/main arm64 libkeyutils1 arm64 1.6.3-4 [9352 B] Get: 27 http://deb.debian.org/debian unstable/main arm64 libkrb5-3 arm64 1.21.3-4 [308 kB] Get: 28 http://deb.debian.org/debian unstable/main arm64 libgssapi-krb5-2 arm64 1.21.3-4 [127 kB] Get: 29 http://deb.debian.org/debian unstable/main arm64 libunistring5 arm64 1.3-1 [449 kB] Get: 30 http://deb.debian.org/debian unstable/main arm64 libidn2-0 arm64 2.3.8-1 [107 kB] Get: 31 http://deb.debian.org/debian unstable/main arm64 libsasl2-modules-db arm64 2.1.28+dfsg1-9 [20.1 kB] Get: 32 http://deb.debian.org/debian unstable/main arm64 libsasl2-2 arm64 2.1.28+dfsg1-9 [55.6 kB] Get: 33 http://deb.debian.org/debian unstable/main arm64 libldap2 arm64 2.6.9+dfsg-1 [179 kB] Get: 34 http://deb.debian.org/debian unstable/main arm64 libnghttp2-14 arm64 1.64.0-1 [71.3 kB] Get: 35 http://deb.debian.org/debian unstable/main arm64 libnghttp3-9 arm64 1.8.0-1 [63.2 kB] Get: 36 http://deb.debian.org/debian unstable/main arm64 libpsl5t64 arm64 0.21.2-1.1+b1 [57.1 kB] Get: 37 http://deb.debian.org/debian unstable/main arm64 libffi8 arm64 3.4.7-1 [21.2 kB] Get: 38 http://deb.debian.org/debian unstable/main arm64 libp11-kit0 arm64 0.25.5-3 [409 kB] Get: 39 http://deb.debian.org/debian unstable/main arm64 libtasn1-6 arm64 4.20.0-2 [47.3 kB] Get: 40 http://deb.debian.org/debian unstable/main arm64 libgnutls30t64 arm64 3.8.9-2 [1374 kB] Get: 41 http://deb.debian.org/debian unstable/main arm64 librtmp1 arm64 2.4+20151223.gitfa8646d.1-2+b5 [56.8 kB] Get: 42 http://deb.debian.org/debian unstable/main arm64 libssh2-1t64 arm64 1.11.1-1 [235 kB] Get: 43 http://deb.debian.org/debian unstable/main arm64 libcurl4t64 arm64 8.12.1-3 [339 kB] Get: 44 http://deb.debian.org/debian unstable/main arm64 libexpat1 arm64 2.6.4-1 [90.7 kB] Get: 45 http://deb.debian.org/debian unstable/main arm64 libjsoncpp26 arm64 1.9.6-3 [72.9 kB] Get: 46 http://deb.debian.org/debian unstable/main arm64 librhash1 arm64 1.4.5-1 [129 kB] Get: 47 http://deb.debian.org/debian unstable/main arm64 libuv1t64 arm64 1.50.0-2 [148 kB] Get: 48 http://deb.debian.org/debian unstable/main arm64 cmake arm64 3.31.6-1 [9912 kB] Get: 49 http://deb.debian.org/debian unstable/main arm64 libdebhelper-perl all 13.24.1 [90.9 kB] Get: 50 http://deb.debian.org/debian unstable/main arm64 libtool all 2.5.4-4 [539 kB] Get: 51 http://deb.debian.org/debian unstable/main arm64 dh-autoreconf all 20 [17.1 kB] Get: 52 http://deb.debian.org/debian unstable/main arm64 libarchive-zip-perl all 1.68-1 [104 kB] Get: 53 http://deb.debian.org/debian unstable/main arm64 libfile-stripnondeterminism-perl all 1.14.1-2 [19.7 kB] Get: 54 http://deb.debian.org/debian unstable/main arm64 dh-strip-nondeterminism all 1.14.1-2 [8620 B] Get: 55 http://deb.debian.org/debian unstable/main arm64 libelf1t64 arm64 0.192-4 [189 kB] Get: 56 http://deb.debian.org/debian unstable/main arm64 dwz arm64 0.15-1+b1 [102 kB] Get: 57 http://deb.debian.org/debian unstable/main arm64 gettext arm64 0.23.1-1 [1610 kB] Get: 58 http://deb.debian.org/debian unstable/main arm64 intltool-debian all 0.35.0+20060710.6 [22.9 kB] Get: 59 http://deb.debian.org/debian unstable/main arm64 po-debconf all 1.0.21+nmu1 [248 kB] Get: 60 http://deb.debian.org/debian unstable/main arm64 debhelper all 13.24.1 [920 kB] Get: 61 http://deb.debian.org/debian unstable/main arm64 libgfortran5 arm64 14.2.0-17 [361 kB] Get: 62 http://deb.debian.org/debian unstable/main arm64 libgfortran-14-dev arm64 14.2.0-17 [418 kB] Get: 63 http://deb.debian.org/debian unstable/main arm64 gfortran-14-aarch64-linux-gnu arm64 14.2.0-17 [9794 kB] Get: 64 http://deb.debian.org/debian unstable/main arm64 gfortran-14 arm64 14.2.0-17 [14.0 kB] Get: 65 http://deb.debian.org/debian unstable/main arm64 gfortran-aarch64-linux-gnu arm64 4:14.2.0-1 [1284 B] Get: 66 http://deb.debian.org/debian unstable/main arm64 gfortran arm64 4:14.2.0-1 [1424 B] Get: 67 http://deb.debian.org/debian unstable/main arm64 libpkgconf3 arm64 1.8.1-4 [35.3 kB] Get: 68 http://deb.debian.org/debian unstable/main arm64 libxc9 arm64 5.2.3-1+b2 [3628 kB] Get: 69 http://deb.debian.org/debian unstable/main arm64 libxc-dev arm64 5.2.3-1+b2 [7373 kB] Get: 70 http://deb.debian.org/debian unstable/main arm64 pkgconf-bin arm64 1.8.1-4 [29.6 kB] Get: 71 http://deb.debian.org/debian unstable/main arm64 pkgconf arm64 1.8.1-4 [26.1 kB] Get: 72 http://deb.debian.org/debian unstable/main arm64 pkg-config arm64 1.8.1-4 [14.0 kB] Fetched 59.6 MB in 1s (104 MB/s) Preconfiguring packages ... Selecting previously unselected package libproc2-0:arm64. (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 ... 19897 files and directories currently installed.) Preparing to unpack .../00-libproc2-0_2%3a4.0.4-7_arm64.deb ... Unpacking libproc2-0:arm64 (2:4.0.4-7) ... Selecting previously unselected package procps. Preparing to unpack .../01-procps_2%3a4.0.4-7_arm64.deb ... Unpacking procps (2:4.0.4-7) ... Selecting previously unselected package sensible-utils. Preparing to unpack .../02-sensible-utils_0.0.24_all.deb ... Unpacking sensible-utils (0.0.24) ... Selecting previously unselected package libmagic-mgc. Preparing to unpack .../03-libmagic-mgc_1%3a5.45-3+b1_arm64.deb ... Unpacking libmagic-mgc (1:5.45-3+b1) ... Selecting previously unselected package libmagic1t64:arm64. Preparing to unpack .../04-libmagic1t64_1%3a5.45-3+b1_arm64.deb ... Unpacking libmagic1t64:arm64 (1:5.45-3+b1) ... Selecting previously unselected package file. Preparing to unpack .../05-file_1%3a5.45-3+b1_arm64.deb ... Unpacking file (1:5.45-3+b1) ... Selecting previously unselected package gettext-base. Preparing to unpack .../06-gettext-base_0.23.1-1_arm64.deb ... Unpacking gettext-base (0.23.1-1) ... Selecting previously unselected package libuchardet0:arm64. Preparing to unpack .../07-libuchardet0_0.0.8-1+b2_arm64.deb ... Unpacking libuchardet0:arm64 (0.0.8-1+b2) ... Selecting previously unselected package groff-base. Preparing to unpack .../08-groff-base_1.23.0-7_arm64.deb ... Unpacking groff-base (1.23.0-7) ... Selecting previously unselected package bsdextrautils. Preparing to unpack .../09-bsdextrautils_2.40.4-5_arm64.deb ... Unpacking bsdextrautils (2.40.4-5) ... Selecting previously unselected package libpipeline1:arm64. Preparing to unpack .../10-libpipeline1_1.5.8-1_arm64.deb ... Unpacking libpipeline1:arm64 (1.5.8-1) ... Selecting previously unselected package man-db. Preparing to unpack .../11-man-db_2.13.0-1_arm64.deb ... Unpacking man-db (2.13.0-1) ... Selecting previously unselected package m4. Preparing to unpack .../12-m4_1.4.19-7_arm64.deb ... Unpacking m4 (1.4.19-7) ... Selecting previously unselected package autoconf. Preparing to unpack .../13-autoconf_2.72-3_all.deb ... Unpacking autoconf (2.72-3) ... Selecting previously unselected package autotools-dev. Preparing to unpack .../14-autotools-dev_20220109.1_all.deb ... Unpacking autotools-dev (20220109.1) ... 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Selecting previously unselected package libbrotli1:arm64. Preparing to unpack .../21-libbrotli1_1.1.0-2+b7_arm64.deb ... Unpacking libbrotli1:arm64 (1.1.0-2+b7) ... Selecting previously unselected package libkrb5support0:arm64. Preparing to unpack .../22-libkrb5support0_1.21.3-4_arm64.deb ... Unpacking libkrb5support0:arm64 (1.21.3-4) ... Selecting previously unselected package libcom-err2:arm64. Preparing to unpack .../23-libcom-err2_1.47.2-1_arm64.deb ... Unpacking libcom-err2:arm64 (1.47.2-1) ... Selecting previously unselected package libk5crypto3:arm64. Preparing to unpack .../24-libk5crypto3_1.21.3-4_arm64.deb ... Unpacking libk5crypto3:arm64 (1.21.3-4) ... Selecting previously unselected package libkeyutils1:arm64. Preparing to unpack .../25-libkeyutils1_1.6.3-4_arm64.deb ... Unpacking libkeyutils1:arm64 (1.6.3-4) ... Selecting previously unselected package libkrb5-3:arm64. Preparing to unpack .../26-libkrb5-3_1.21.3-4_arm64.deb ... Unpacking libkrb5-3:arm64 (1.21.3-4) ... Selecting previously unselected package libgssapi-krb5-2:arm64. Preparing to unpack .../27-libgssapi-krb5-2_1.21.3-4_arm64.deb ... Unpacking libgssapi-krb5-2:arm64 (1.21.3-4) ... Selecting previously unselected package libunistring5:arm64. Preparing to unpack .../28-libunistring5_1.3-1_arm64.deb ... Unpacking libunistring5:arm64 (1.3-1) ... Selecting previously unselected package libidn2-0:arm64. Preparing to unpack .../29-libidn2-0_2.3.8-1_arm64.deb ... Unpacking libidn2-0:arm64 (2.3.8-1) ... Selecting previously unselected package libsasl2-modules-db:arm64. Preparing to unpack .../30-libsasl2-modules-db_2.1.28+dfsg1-9_arm64.deb ... Unpacking libsasl2-modules-db:arm64 (2.1.28+dfsg1-9) ... Selecting previously unselected package libsasl2-2:arm64. Preparing to unpack .../31-libsasl2-2_2.1.28+dfsg1-9_arm64.deb ... Unpacking libsasl2-2:arm64 (2.1.28+dfsg1-9) ... Selecting previously unselected package libldap2:arm64. Preparing to unpack .../32-libldap2_2.6.9+dfsg-1_arm64.deb ... Unpacking libldap2:arm64 (2.6.9+dfsg-1) ... Selecting previously unselected package libnghttp2-14:arm64. Preparing to unpack .../33-libnghttp2-14_1.64.0-1_arm64.deb ... Unpacking libnghttp2-14:arm64 (1.64.0-1) ... Selecting previously unselected package libnghttp3-9:arm64. Preparing to unpack .../34-libnghttp3-9_1.8.0-1_arm64.deb ... Unpacking libnghttp3-9:arm64 (1.8.0-1) ... Selecting previously unselected package libpsl5t64:arm64. Preparing to unpack .../35-libpsl5t64_0.21.2-1.1+b1_arm64.deb ... Unpacking libpsl5t64:arm64 (0.21.2-1.1+b1) ... Selecting previously unselected package libffi8:arm64. Preparing to unpack .../36-libffi8_3.4.7-1_arm64.deb ... Unpacking libffi8:arm64 (3.4.7-1) ... Selecting previously unselected package libp11-kit0:arm64. Preparing to unpack .../37-libp11-kit0_0.25.5-3_arm64.deb ... Unpacking libp11-kit0:arm64 (0.25.5-3) ... Selecting previously unselected package libtasn1-6:arm64. Preparing to unpack .../38-libtasn1-6_4.20.0-2_arm64.deb ... 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Setting up debhelper (13.24.1) ... Setting up cmake (3.31.6-1) ... Processing triggers for libc-bin (2.41-4) ... Reading package lists... Building dependency tree... Reading state information... Reading extended state information... Initializing package states... Writing extended state information... Building tag database... -> Finished parsing the build-deps Reading package lists... Building dependency tree... Reading state information... fakeroot is already the newest version (1.37-1). 0 upgraded, 0 newly installed, 0 to remove and 0 not upgraded. I: Building the package I: Running cd /build/reproducible-path/libgridxc-2.1.0/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-buildpackage -us -uc -b && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games" HOME="/nonexistent/first-build" dpkg-genchanges -S > ../libgridxc_2.1.0-1_source.changes dpkg-buildpackage: info: source package libgridxc dpkg-buildpackage: info: source version 2.1.0-1 dpkg-buildpackage: info: source distribution unstable dpkg-buildpackage: info: source changed by Michael Banck dpkg-source --before-build . dpkg-buildpackage: info: host architecture arm64 debian/rules clean dh clean --buildsystem=cmake dh_auto_clean -O--buildsystem=cmake dh_autoreconf_clean -O--buildsystem=cmake dh_clean -O--buildsystem=cmake debian/rules binary dh binary --buildsystem=cmake dh_update_autotools_config -O--buildsystem=cmake dh_autoreconf -O--buildsystem=cmake libtoolize: putting auxiliary files in AC_CONFIG_AUX_DIR, 'config/gnu'. libtoolize: copying file 'config/gnu/ltmain.sh' libtoolize: putting macros in AC_CONFIG_MACRO_DIRS, 'config/m4'. libtoolize: copying file 'config/m4/libtool.m4' libtoolize: copying file 'config/m4/ltoptions.m4' libtoolize: copying file 'config/m4/ltsugar.m4' libtoolize: copying file 'config/m4/ltversion.m4' libtoolize: copying file 'config/m4/lt~obsolete.m4' configure.ac:470: warning: AC_OUTPUT should be used without arguments. configure.ac:470: You should run autoupdate. configure.ac:273: installing 'config/gnu/compile' configure.ac:28: installing 'config/gnu/config.guess' configure.ac:28: installing 'config/gnu/config.sub' configure.ac:29: installing 'config/gnu/install-sh' configure.ac:29: installing 'config/gnu/missing' parallel-tests: installing 'config/gnu/test-driver' debian/rules override_dh_auto_configure make[1]: Entering directory '/build/reproducible-path/libgridxc-2.1.0' dh_auto_configure -- \ -DCMAKE_BUILD_TYPE= \ -DWITH_LIBXC=YES cd obj-aarch64-linux-gnu && DEB_PYTHON_INSTALL_LAYOUT=deb PKG_CONFIG=/usr/bin/pkg-config cmake -DCMAKE_INSTALL_PREFIX=/usr -DCMAKE_BUILD_TYPE=None -DCMAKE_INSTALL_SYSCONFDIR=/etc -DCMAKE_INSTALL_LOCALSTATEDIR=/var -DCMAKE_EXPORT_NO_PACKAGE_REGISTRY=ON -DCMAKE_FIND_USE_PACKAGE_REGISTRY=OFF -DCMAKE_FIND_PACKAGE_NO_PACKAGE_REGISTRY=ON -DFETCHCONTENT_FULLY_DISCONNECTED=ON -DCMAKE_INSTALL_RUNSTATEDIR=/run "-GUnix Makefiles" -DCMAKE_VERBOSE_MAKEFILE=ON -DCMAKE_INSTALL_LIBDIR=lib/aarch64-linux-gnu -DCMAKE_BUILD_TYPE= -DWITH_LIBXC=YES .. -- The Fortran compiler identification is GNU 14.2.0 -- Detecting Fortran compiler ABI info -- Detecting Fortran compiler ABI info - done -- Check for working Fortran compiler: /usr/bin/f95 - skipped -- Allowing non-prefixed variables (e.g. WITH_MPI --> LIBGRIDXC_WITH_MPI) -- >> Using value of deprecated WITH_LIBXC option variable for new variable LIBGRIDXC_WITH_LIBXC -- Setting build type to 'RelWithDebInfo' as none was specified. Using a GNU compiler -- Adding '-fallow-argument-mismatch' for GNU >= 10.0 -- Flags for Fortran-compiler (build type: RelWithDebInfo): -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -- Flags for C-compiler (build type: RelWithDebInfo): -g -O2 -- Searching for libXC library -- Checking for module 'libxc' -- Found libxc, version 5.2.3 -- Using pkg-config to search for libxcf03 -- Checking for module 'libxcf03' -- Found libxcf03, version 5.2.3 -- Using pkg-config to search for libxcf03 - found -- Searching for libXC library - found -- Configuring libgridxc tests... -- Configuring done (0.9s) -- Generating done (0.1s) CMake Warning: Manually-specified variables were not used by the project: CMAKE_EXPORT_NO_PACKAGE_REGISTRY CMAKE_FIND_PACKAGE_NO_PACKAGE_REGISTRY FETCHCONTENT_FULLY_DISCONNECTED -- Build files have been written to: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0' dh_auto_build -O--buildsystem=cmake cd obj-aarch64-linux-gnu && make -j12 "INSTALL=install --strip-program=true" VERBOSE=1 make[1]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' /usr/bin/cmake -S/build/reproducible-path/libgridxc-2.1.0 -B/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/CMakeFiles /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu//CMakeFiles/progress.marks make -f CMakeFiles/Makefile2 all make[2]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f CMakeFiles/libgridxc-lib.dir/build.make CMakeFiles/libgridxc-lib.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/CMakeFiles/libgridxc-lib.dir/DependInfo.cmake "--color=" Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/CMakeFiles/libgridxc-lib.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/CMakeFiles/libgridxc-lib.dir/depend.internal". 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include/gridxc_precision.mod CMakeFiles/libgridxc-lib.dir/gridxc_precision.mod.stamp GNU /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/precision.F90.o.provides.build /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-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/sorting.F90 -o CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o [ 15%] Building Fortran object 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CMakeFiles/libgridxc-lib.dir/src/array.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/am05.F90 -o CMakeFiles/libgridxc-lib.dir/src/am05.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/ldaxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/ldaxc.F90.o [ 23%] Building Fortran object 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-ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/fftr.F90 -o CMakeFiles/libgridxc-lib.dir/src/fftr.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_fftr.mod CMakeFiles/libgridxc-lib.dir/gridxc_fftr.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/fftr.F90.o.provides.build /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_vv_vdwxc.mod CMakeFiles/libgridxc-lib.dir/gridxc_vv_vdwxc.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/vv_vdwxc.F90.o.provides.build [ 54%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/vdwxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/vdwxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/vdwxc.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_vdwxc.mod CMakeFiles/libgridxc-lib.dir/gridxc_vdwxc.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/vdwxc.F90.o.provides.build [ 56%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/xcmod.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/xcmod.F90 -o CMakeFiles/libgridxc-lib.dir/src/xcmod.F90.o /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 [ 60%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o [ 60%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/atomxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/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 /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc_cell.mod CMakeFiles/libgridxc-lib.dir/gridxc_cell.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o.provides.build [ 62%] Building Fortran object CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -Jinclude -fPIC -c /build/reproducible-path/libgridxc-2.1.0/src/gridxc.F90 -o CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o /usr/bin/cmake -E cmake_copy_f90_mod include/gridxc.mod CMakeFiles/libgridxc-lib.dir/gridxc.mod.stamp GNU /usr/bin/cmake -E touch CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o.provides.build [ 64%] Linking Fortran static library libgridxc.a /usr/bin/cmake -P CMakeFiles/libgridxc-lib.dir/cmake_clean_target.cmake /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-lib.dir/link.txt --verbose=1 /usr/bin/ar qc libgridxc.a "CMakeFiles/libgridxc-lib.dir/src/alloc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/am05.F90.o" "CMakeFiles/libgridxc-lib.dir/src/array.F90.o" "CMakeFiles/libgridxc-lib.dir/src/atomxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/bessph.F90.o" "CMakeFiles/libgridxc-lib.dir/src/cellsubs.F90.o" "CMakeFiles/libgridxc-lib.dir/src/cellxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/chkgmx.F90.o" "CMakeFiles/libgridxc-lib.dir/src/debugxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/fft3d.F90.o" "CMakeFiles/libgridxc-lib.dir/src/fftr.F90.o" "CMakeFiles/libgridxc-lib.dir/src/ggaxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/gridxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/gridxc_config.F90.o" "CMakeFiles/libgridxc-lib.dir/src/gridxc_fft_gpfa.F90.o" "CMakeFiles/libgridxc-lib.dir/src/interpolation.F90.o" "CMakeFiles/libgridxc-lib.dir/src/ldaxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/m_io.F90.o" "CMakeFiles/libgridxc-lib.dir/src/m_walltime.F90.o" "CMakeFiles/libgridxc-lib.dir/src/mesh1d.F90.o" "CMakeFiles/libgridxc-lib.dir/src/mesh3d.F90.o" "CMakeFiles/libgridxc-lib.dir/src/minvec.F90.o" "CMakeFiles/libgridxc-lib.dir/src/moreParallelSubs.F90.o" "CMakeFiles/libgridxc-lib.dir/src/precision.F90.o" "CMakeFiles/libgridxc-lib.dir/src/radfft.F90.o" "CMakeFiles/libgridxc-lib.dir/src/sorting.F90.o" "CMakeFiles/libgridxc-lib.dir/src/sys.F90.o" "CMakeFiles/libgridxc-lib.dir/src/vdwxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/vv_vdwxc.F90.o" "CMakeFiles/libgridxc-lib.dir/src/xc_hybrids.F90.o" "CMakeFiles/libgridxc-lib.dir/src/xc_xwpbe.F90.o" "CMakeFiles/libgridxc-lib.dir/src/xcmod.F90.o" /usr/bin/ranlib libgridxc.a make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' [ 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[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/depend cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers 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'/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers 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/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-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 make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake "--color=" 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-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake "--color=" Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/depend.internal". Scanning dependencies of target libgridxc-test_libxc2 make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_libxc2.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc2.dir/build Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.dir/depend.internal". Scanning dependencies of target libgridxc-test2 make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/depend.internal". make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' Scanning dependencies of target libgridxc-test3 Scanning dependencies of target libgridxc-test1 Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/depend.internal". Scanning dependencies of target libgridxc-test4 make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test2.dir/build.make Testers/CMakeFiles/libgridxc-test2.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' Scanning dependencies of target libgridxc-test6 Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/depend.internal". Scanning dependencies of target libgridxc-test_libxc make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/depend.internal". Scanning dependencies of target libgridxc-test_match make -f Testers/CMakeFiles/libgridxc-test1.dir/build.make Testers/CMakeFiles/libgridxc-test1.dir/build make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test4.dir/build.make Testers/CMakeFiles/libgridxc-test4.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test6.dir/build.make Testers/CMakeFiles/libgridxc-test6.dir/build make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". Dependee "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/CMakeDirectoryInformation.cmake" is newer than depender "/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/depend.internal". [ 66%] Building Fortran object Testers/CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o Scanning dependencies of target libgridxc-test_hse06 [ 68%] Building Fortran object Testers/CMakeFiles/libgridxc-test1.dir/test1.f90.o make -f Testers/CMakeFiles/libgridxc-test_match.dir/build.make Testers/CMakeFiles/libgridxc-test_match.dir/build cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test_libxc2.F90 -o CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-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-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test1.f90 -o CMakeFiles/libgridxc-test1.dir/test1.f90.o [ 70%] Building Fortran object Testers/CMakeFiles/libgridxc-test3.dir/test3.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test3.F90 -o CMakeFiles/libgridxc-test3.dir/test3.F90.o [ 72%] Building Fortran object Testers/CMakeFiles/libgridxc-test2.dir/test2.F90.o [ 74%] Building Fortran object Testers/CMakeFiles/libgridxc-test4.dir/test4.F90.o [ 76%] Building Fortran object Testers/CMakeFiles/libgridxc-test_match.dir/test_match.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test_match.F90 -o CMakeFiles/libgridxc-test_match.dir/test_match.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test4.F90 -o CMakeFiles/libgridxc-test4.dir/test4.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test2.F90 -o CMakeFiles/libgridxc-test2.dir/test2.F90.o [ 78%] Building Fortran object Testers/CMakeFiles/libgridxc-test6.dir/test6.f90.o [ 80%] Building Fortran object Testers/CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o [ 82%] Building Fortran object Testers/CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test6.f90 -o CMakeFiles/libgridxc-test6.dir/test6.f90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test_libxc.F90 -o CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/f95 -DHAVE_LIBXC -I/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/include -I/usr/include -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace -c /build/reproducible-path/libgridxc-2.1.0/Testers/test_hse06.F90 -o CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o [ 84%] Linking Fortran executable libgridxc-test_libxc cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_libxc.dir/link.txt --verbose=1 [ 86%] Linking Fortran executable libgridxc-test_match cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_match.dir/link.txt --verbose=1 [ 88%] Linking Fortran executable libgridxc-test_hse06 [ 90%] Linking Fortran executable libgridxc-test2 cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test_hse06.dir/link.txt --verbose=1 cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test2.dir/link.txt --verbose=1 [ 92%] Linking Fortran executable libgridxc-test6 cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test6.dir/link.txt --verbose=1 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test_libxc.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test_libxc.dir/test_libxc.F90.o" -o libgridxc-test_libxc ../libgridxc.a /usr/lib/aarch64-linux-gnu/libxcf03.so /usr/lib/aarch64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' [ 94%] Linking Fortran executable libgridxc-test_libxc2 [ 94%] Built target libgridxc-test_libxc cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-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 -Wl,--dependency-file=CMakeFiles/libgridxc-test_match.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test_match.dir/test_match.F90.o" -o libgridxc-test_match ../libgridxc.a /usr/lib/aarch64-linux-gnu/libxcf03.so /usr/lib/aarch64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test2.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test2.dir/test2.F90.o" -o libgridxc-test2 ../libgridxc.a /usr/lib/aarch64-linux-gnu/libxcf03.so /usr/lib/aarch64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test_hse06.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test_hse06.dir/test_hse06.F90.o" -o libgridxc-test_hse06 ../libgridxc.a /usr/lib/aarch64-linux-gnu/libxcf03.so /usr/lib/aarch64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' [ 96%] Linking Fortran executable libgridxc-test4 cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test4.dir/link.txt --verbose=1 [ 96%] Built target libgridxc-test_match [ 96%] Built target libgridxc-test2 [ 96%] Built target libgridxc-test_hse06 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test6.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test6.dir/test6.f90.o" -o libgridxc-test6 ../libgridxc.a /usr/lib/aarch64-linux-gnu/libxcf03.so /usr/lib/aarch64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' [ 96%] Built target libgridxc-test6 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test_libxc2.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test_libxc2.dir/test_libxc2.F90.o" -o libgridxc-test_libxc2 ../libgridxc.a /usr/lib/aarch64-linux-gnu/libxcf03.so /usr/lib/aarch64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test4.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test4.dir/test4.F90.o" -o libgridxc-test4 ../libgridxc.a /usr/lib/aarch64-linux-gnu/libxcf03.so /usr/lib/aarch64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' [ 96%] Built target libgridxc-test_libxc2 [ 96%] Built target libgridxc-test4 [ 98%] Linking Fortran executable libgridxc-test1 cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test1.dir/link.txt --verbose=1 [100%] Linking Fortran executable libgridxc-test3 cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers && /usr/bin/cmake -E cmake_link_script CMakeFiles/libgridxc-test3.dir/link.txt --verbose=1 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test1.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test1.dir/test1.f90.o" -o libgridxc-test1 ../libgridxc.a /usr/lib/aarch64-linux-gnu/libxcf03.so /usr/lib/aarch64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' [100%] Built target libgridxc-test1 /usr/bin/f95 -Wl,-z,relro -Wl,--dependency-file=CMakeFiles/libgridxc-test3.dir/link.d -g -O2 -ffile-prefix-map=/build/reproducible-path/libgridxc-2.1.0=. -fstack-protector-strong -fstack-clash-protection -mbranch-protection=standard -fallow-argument-mismatch -g -Ofast -march=native -fbacktrace "CMakeFiles/libgridxc-test3.dir/test3.F90.o" -o libgridxc-test3 ../libgridxc.a /usr/lib/aarch64-linux-gnu/libxcf03.so /usr/lib/aarch64-linux-gnu/libxc.so make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' [100%] Built target libgridxc-test3 make[2]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/CMakeFiles 0 make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' dh_auto_test -O--buildsystem=cmake cd obj-aarch64-linux-gnu && make -j12 test ARGS\+=--verbose ARGS\+=-j12 make[1]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' Running tests... /usr/bin/ctest --force-new-ctest-process --verbose -j12 UpdateCTestConfiguration from :/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/DartConfiguration.tcl UpdateCTestConfiguration from :/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/DartConfiguration.tcl Test project /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu Constructing a list of tests Done constructing a list of tests Updating test list for fixtures Added 0 tests to meet fixture requirements Checking test dependency graph... Checking test dependency graph end Connected to MAKE jobserver test 1 Start 1: libgridxc_test1 1: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/libgridxc-test1 1: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers 1: Test timeout computed to be: 10000000 test 2 Start 2: libgridxc_test2 2: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/libgridxc-test2 2: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers 2: Test timeout computed to be: 10000000 test 3 Start 3: libgridxc_test3 3: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/libgridxc-test3 3: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers 3: Test timeout computed to be: 10000000 test 4 Start 4: libgridxc_test4 4: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/libgridxc-test4 4: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers 4: Test timeout computed to be: 10000000 test 5 Start 5: libgridxc_test6 5: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/libgridxc-test6 5: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers 5: Test timeout computed to be: 10000000 test 6 Start 6: libgridxc_test_libxc 6: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/libgridxc-test_libxc 6: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers 6: Test timeout computed to be: 10000000 test 7 Start 7: libgridxc_test_libxc2 7: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/libgridxc-test_libxc2 7: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers 7: Test timeout computed to be: 10000000 test 8 Start 8: libgridxc_test_match 8: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/libgridxc-test_match 8: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers 8: Test timeout computed to be: 10000000 test 9 Start 9: libgridxc_test_hse06 9: Test command: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/libgridxc-test_hse06 9: Working Directory: /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers 9: Test timeout computed to be: 10000000 1: 1: iSpin dens gradDens 1: 1 0.012454543 -0.061346294 -0.068923405 -0.106577679 1: 2 0.009313792 -0.097071676 0.032777474 0.040672409 1: 3 -0.001792404 -0.094792515 0.005206488 0.032900796 1: 4 0.000126122 -0.028726647 0.033749071 0.070134047 1: 1: func auth xyz iSpin Ex|Ec deriv(anal) deriv(num) diff err 1: LDA PZ 0 1 Ex -0.286794975 -0.286794983 0.000000008 0 1: LDA PZ 0 1 Ec -0.045318233 -0.045318233 0.000000000 0 1: LDA PZ 0 2 Ex -0.260107171 -0.260107171 0.000000000 0 1: LDA PZ 0 2 Ec -0.055267488 -0.055267488 0.000000000 0 1: LDA PZ 0 3 Ex 0.015230538 0.015230537 0.000000000 0 1: LDA PZ 0 3 Ec -0.005677969 -0.005677969 0.000000000 0 1: LDA PZ 0 4 Ex -0.001071693 -0.001071694 0.000000001 0 1: LDA PZ 0 4 Ec 0.000399529 0.000399529 0.000000000 0 1: 1: LDA PW92 0 1 Ex -0.286794967 -0.286794960 0.000000007 0 1: LDA PW92 0 1 Ec -0.045526830 -0.045526830 0.000000000 0 1: LDA PW92 0 2 Ex -0.260107164 -0.260107155 0.000000009 0 1: LDA PW92 0 2 Ec -0.054196335 -0.054196335 0.000000000 0 1: LDA PW92 0 3 Ex 0.015230537 0.015230537 0.000000000 0 1: LDA PW92 0 3 Ec -0.004947624 -0.004947624 0.000000000 0 1: LDA PW92 0 4 Ex -0.001071693 -0.001071692 0.000000001 0 1: LDA PW92 0 4 Ec 0.000348138 0.000348138 0.000000000 0 1: 1: GGA PW91 0 1 Ex -0.568922409 -0.526661612 0.042260796 2 1: GGA PW91 0 1 Ec -0.001425545 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-0.957977822 -0.964932172 0.006954351 2 1: GGA C09 0 3 Ex -0.064612418 -0.027339866 0.037272551 2 1: GGA C09 0 4 Ex -0.026225098 -0.102589972 0.076364873 2 1: GGA BH 0 1 Ex -0.785994404 -0.776770198 0.009224206 2 1: GGA BH 0 2 Ex -0.783073213 -0.792297418 0.009224205 2 1: GGA BH 0 3 Ex 0.001618117 0.054853184 0.053235067 2 1: GGA BH 0 4 Ex 0.000656767 -0.109987983 0.110644750 2 1: 1: iSpin dens gradDens 1: 1 0.083363325 1.002659819 0.090232260 0.687805719 1: 2 0.184753956 1.067178857 -0.359815306 0.338178942 1: 3 0.039558639 -0.265118813 1.031011586 -0.513156481 1: 4 0.098572619 1.287666699 0.594205297 0.527799481 1: GGA PW91 0 1 Ex -0.276399047 -0.347230050 0.070831003 2 1: GGA PW91 0 2 Ex -0.557771408 -0.486940373 0.070831035 2 1: GGA PW91 0 3 Ex -0.109780436 -0.043736692 0.066043745 2 1: GGA PW91 0 4 Ex -0.273552008 -0.336484309 0.062932302 2 1: GGA PBE 0 1 Ex -0.622324831 -0.689098162 0.066773331 2 1: GGA PBE 0 2 Ex -0.709155656 -0.642382292 0.066773364 2 1: GGA PBE 0 3 Ex -0.033877975 0.024033291 0.057911266 2 1: GGA PBE 0 4 Ex -0.084417484 -0.141999267 0.057581783 2 1: GGA RPBE 0 1 Ex -0.604261697 -0.702161719 0.097900022 2 1: GGA RPBE 0 2 Ex -0.658774971 -0.560874914 0.097900057 2 1: GGA RPBE 0 3 Ex -0.021268937 0.063871572 0.085140508 2 1: GGA RPBE 0 4 Ex -0.052998153 -0.137515705 0.084517551 2 1: GGA revPBE 0 1 Ex -0.695936158 -0.792265285 0.096329127 2 1: GGA revPBE 0 2 Ex -0.690862326 -0.594533165 0.096329162 2 1: GGA revPBE 0 3 Ex 0.001979610 0.085373635 0.083394025 2 1: GGA revPBE 0 4 Ex 0.004932812 -0.078075948 0.083008760 2 1: GGA LYP 0 1 Ex -0.611305494 -0.740243758 0.128938265 2 1: GGA LYP 0 1 Ec -0.404519962 -0.543493572 0.138973610 2 1: GGA LYP 0 2 Ex -0.657800833 -0.528862568 0.128938265 2 1: GGA LYP 0 2 Ec -0.172763747 -0.033790137 0.138973610 2 1: GGA LYP 0 3 Ex -0.018140654 -0.034051661 0.015911007 2 1: GGA LYP 0 3 Ec 0.090422166 0.304960954 0.214538788 2 1: GGA LYP 0 4 Ex -0.045203066 -0.105129934 0.059926867 2 1: GGA LYP 0 4 Ec 0.225314873 0.067744002 0.157570871 2 1: GGA WC 0 1 Ex -0.603434592 -0.671343346 0.067908754 2 1: GGA WC 0 2 Ex -0.664515247 -0.596606461 0.067908785 2 1: GGA WC 0 3 Ex -0.023831271 0.034982032 0.058813303 2 1: GGA WC 0 4 Ex -0.059383003 -0.117910727 0.058527724 2 1: GGA PBEJsJrLO 0 1 Ex -0.609783107 -0.673020089 0.063236983 2 1: GGA PBEJsJrLO 0 2 Ex -0.679854633 -0.616617619 0.063237014 2 1: GGA PBEJsJrLO 0 3 Ex -0.027339155 0.027425762 0.054764918 2 1: GGA PBEJsJrLO 0 4 Ex -0.068123985 -0.122624369 0.054500383 2 1: GGA PBEJsJrHEG 0 1 Ex -0.567880959 -0.613735514 0.045854555 2 1: GGA PBEJsJrHEG 0 2 Ex -0.690869749 -0.645015164 0.045854585 2 1: GGA PBEJsJrHEG 0 3 Ex -0.047985392 -0.008216114 0.039769278 2 1: GGA PBEJsJrHEG 0 4 Ex -0.119570488 -0.159113221 0.039542733 2 1: GGA PBEGcGxLO 0 1 Ex -0.605405491 -0.665104568 0.059699077 2 1: GGA PBEGcGxLO 0 2 Ex -0.670457583 -0.610758475 0.059699108 2 1: GGA PBEGcGxLO 0 3 Ex -0.025380769 0.026256151 0.051636921 2 1: GGA PBEGcGxLO 0 4 Ex -0.063244059 -0.114669607 0.051425548 2 1: GGA PBEGcGxHEG 0 1 Ex -0.562619565 -0.607519438 0.044899872 2 1: GGA PBEGcGxHEG 0 2 Ex -0.678408306 -0.633508405 0.044899902 2 1: GGA PBEGcGxHEG 0 3 Ex -0.045176216 -0.006261540 0.038914676 2 1: GGA PBEGcGxHEG 0 4 Ex -0.112570554 -0.151279334 0.038708780 2 1: GGA PBESOL 0 1 Ex -0.605405491 -0.665104568 0.059699077 2 1: GGA PBESOL 0 2 Ex -0.670457583 -0.610758475 0.059699108 2 1: GGA PBESOL 0 3 Ex -0.025380769 0.026256151 0.051636921 2 1: GGA PBESOL 0 4 Ex -0.063244059 -0.114669607 0.051425548 2 1: GGA AM05 0 1 Ex -0.532952749 -0.610444210 0.077491461 2 1: GGA AM05 0 1 Ec -0.103322251 -0.102927903 0.000394347 2 6: 1 7.200 0.000072999 -0.152957536 -0.152957538 0.000000003 6: 1 7.400 0.000050669 -0.141563831 -0.141563835 0.000000004 6: 1 7.600 0.000034818 -0.129595146 -0.129595152 0.000000006 6: 1 7.800 0.000023687 -0.117391049 -0.117391056 0.000000007 6: 1 8.000 0.000015954 -0.105308033 -0.105308040 0.000000008 6: 1 8.200 0.000010638 -0.093651613 -0.093651624 0.000000011 6: 1 8.400 0.000007022 -0.082649174 -0.082649186 0.000000011 6: 1 8.600 0.000004589 -0.072448262 -0.072448275 0.000000013 6: 1 8.800 0.000002969 -0.063127570 -0.063127580 0.000000010 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 -0.609191692 -0.531700231 0.077491461 2 1: GGA AM05 0 2 Ec -0.061824918 -0.062219265 0.000394347 2 1: GGA AM05 0 3 Ex -0.029745439 -0.044520706 0.014775267 2 1: GGA AM05 0 3 Ec 0.016190628 0.015848324 0.000342305 2 1: GGA AM05 0 4 Ex -0.074119987 -0.108043856 0.033923869 2 1: GGA AM05 0 4 Ec 0.040343972 0.040684155 0.000340182 2 1: GGA PW86 0 1 Ex -0.706663540 -0.778927683 0.072264143 2 1: GGA PW86 0 2 Ex -0.766255431 -0.693991253 0.072264178 2 1: GGA PW86 0 3 Ex -0.023250414 0.008601684 0.031852098 2 1: GGA PW86 0 4 Ex -0.057935617 -0.107883367 0.049947749 2 1: GGA B88 0 1 Ex -0.611187717 -0.740105955 0.128918239 2 1: GGA B88 0 2 Ex -0.657594234 -0.528675956 0.128918277 2 1: GGA B88 0 3 Ex -0.018105999 -0.034029911 0.015923912 2 1: GGA B88 0 4 Ex -0.045116712 -0.105028116 0.059911404 2 1: GGA C09 0 1 Ex -0.683027079 -0.761684208 0.078657129 2 1: GGA C09 0 2 Ex -0.646519460 -0.567862299 0.078657160 2 1: GGA C09 0 3 Ex 0.014243838 0.082649420 0.068405582 2 1: GGA C09 0 4 Ex 0.035492941 -0.032412132 0.067905072 2 1: GGA BH 0 1 Ex -0.629508995 -0.742361164 0.112852169 2 1: GGA BH 0 2 Ex -0.575659151 -0.462806949 0.112852202 2 1: GGA BH 0 3 Ex 0.021010093 0.088872585 0.067862493 2 1: GGA BH 0 4 Ex 0.052353163 -0.032920267 0.085273430 2 1: 1: iSpin dens gradDens 1: 1 0.011823007 0.127642734 0.171177896 -0.100851757 1: 2 0.027207346 0.041356974 0.048934977 -0.051651237 1: 3 -0.014279048 -0.184287664 0.056846076 0.057698292 1: 4 0.010158580 0.043352789 -0.160691567 -0.112515261 1: GGA PW91 0 1 Ex -0.150869746 -0.198919836 0.048050090 2 1: GGA PW91 0 2 Ex -0.353640786 -0.305590700 0.048050085 2 1: GGA PW91 0 3 Ex 0.188202919 0.207301600 0.019098681 2 1: GGA PW91 0 4 Ex -0.133893687 -0.143432256 0.009538569 2 1: GGA PBE 0 1 Ex -0.264156111 -0.309026617 0.044870506 2 1: GGA PBE 0 2 Ex -0.401821508 -0.356951006 0.044870502 2 1: GGA PBE 0 3 Ex 0.127774803 0.145609670 0.017834867 2 1: GGA PBE 0 4 Ex -0.090903157 -0.099810551 0.008907394 2 1: GGA RPBE 0 1 Ex -0.277886236 -0.329504449 0.051618213 2 1: GGA RPBE 0 2 Ex -0.434005865 -0.382387657 0.051618208 2 1: GGA RPBE 0 3 Ex 0.144903187 0.165420094 0.020516907 2 1: GGA RPBE 0 4 Ex -0.103088848 -0.113335751 0.010246904 2 1: GGA revPBE 0 1 Ex -0.281578849 -0.359719952 0.078141102 2 1: GGA revPBE 0 2 Ex -0.389520430 -0.311379333 0.078141098 2 1: GGA revPBE 0 3 Ex 0.100186499 0.131245571 0.031059072 2 1: GGA revPBE 0 4 Ex -0.071275939 -0.086787996 0.015512056 2 1: GGA LYP 0 1 Ex -1.306499143 -1.420595160 0.114096017 2 1: GGA LYP 0 1 Ec -0.901594362 -1.245351145 0.343756784 2 1: GGA LYP 0 2 Ex -0.773404752 -0.659308735 0.114096017 2 1: GGA LYP 0 2 Ec -0.602245670 -0.258488886 0.343756784 2 1: GGA LYP 0 3 Ex -0.494794132 -0.468997738 0.025796393 2 1: GGA LYP 0 3 Ec -0.277841933 -0.062025325 0.215816608 2 1: GGA LYP 0 4 Ex 0.352012663 0.301877907 0.050134756 2 1: GGA LYP 0 4 Ec 0.197665802 0.240725004 0.043059202 2 1: GGA WC 0 1 Ex -0.246894048 -0.304173231 0.057279183 2 1: GGA WC 0 2 Ex -0.361357729 -0.304078550 0.057279178 2 1: GGA WC 0 3 Ex 0.106240018 0.129007014 0.022766997 2 1: GGA WC 0 4 Ex -0.075582609 -0.086953294 0.011370684 2 1: GGA PBEJsJrLO 0 1 Ex -0.250700668 -0.300568294 0.049867625 2 1: GGA PBEJsJrLO 0 2 Ex -0.370280675 -0.320413054 0.049867621 2 1: GGA PBEJsJrLO 0 3 Ex 0.110988760 0.130809854 0.019821093 2 1: GGA PBEJsJrLO 0 4 Ex -0.078961019 -0.088860410 0.009899390 2 1: GGA PBEJsJrHEG 0 1 Ex -0.240479693 -0.271239647 0.030759955 2 2/9 Test #9: libgridxc_test_hse06 ............. Passed 0.02 sec 1: GGA PBEJsJrHEG 0 2 Ex -0.376688399 -0.345928448 0.030759951 2 1: GGA PBEJsJrHEG 0 3 Ex 0.126422768 0.138649055 0.012226287 2 1: GGA PBEJsJrHEG 0 4 Ex -0.089941275 -0.096047535 0.006106260 2 1: GGA PBEGcGxLO 0 1 Ex -0.244204747 -0.295594029 0.051389282 2 1: GGA PBEGcGxLO 0 2 Ex -0.355053692 -0.303664414 0.051389278 2 1: GGA PBEGcGxLO 0 3 Ex 0.102884984 0.123310897 0.020425913 2 1: GGA PBEGcGxLO 0 4 Ex -0.073195729 -0.083397189 0.010201460 2 1: GGA PBEGcGxHEG 0 1 Ex -0.235287479 -0.268147844 0.032860365 2 1: GGA PBEGcGxHEG 0 2 Ex -0.364517345 -0.331656984 0.032860361 2 1: GGA PBEGcGxHEG 0 3 Ex 0.119945324 0.133006469 0.013061146 2 1: GGA PBEGcGxHEG 0 4 Ex -0.085333011 -0.091856230 0.006523220 2 1: GGA PBESOL 0 1 Ex -0.244204747 -0.295594029 0.051389282 2 1: GGA PBESOL 0 2 Ex -0.355053692 -0.303664414 0.051389278 2 1: GGA PBESOL 0 3 Ex 0.102884984 0.123310897 0.020425913 2 1: GGA PBESOL 0 4 Ex -0.073195729 -0.083397189 0.010201460 2 1: GGA AM05 0 1 Ex -1.061723584 -1.134546860 0.072823275 2 1: GGA AM05 0 1 Ec -0.097835769 -0.097667288 0.000168481 2 1: GGA AM05 0 2 Ex -0.648229336 -0.575406061 0.072823276 2 1: GGA AM05 0 2 Ec -0.055503678 -0.055672160 0.000168481 2 1: GGA AM05 0 3 Ex -0.383786682 -0.365331802 0.018454880 2 1: GGA AM05 0 3 Ec -0.039290734 -0.039357701 0.000066967 2 1: GGA AM05 0 4 Ex 0.273038348 0.243836349 0.029201998 2 1: GGA AM05 0 4 Ec 0.027952708 0.027986154 0.000033446 2 1: GGA PW86 0 1 Ex -0.733480219 -0.790787724 0.057307504 2 1: GGA PW86 0 2 Ex -0.587765007 -0.530457505 0.057307502 2 1: GGA PW86 0 3 Ex -0.135246277 -0.113229274 0.022017003 2 1: GGA PW86 0 4 Ex 0.096218607 0.083772277 0.012446331 2 1: GGA B88 0 1 Ex -1.306466985 -1.420556766 0.114089782 2 6: 1 9.000 0.000001902 -0.054712232 -0.054712227 -0.000000005 7: 1 3.200 0.013240188 -0.656330566 -0.656330563 -0.000000003 6: 1 9.200 0.000001206 -0.047188843 -0.047188796 -0.000000047 6: 1 9.400 0.000000757 -0.040518186 -0.040518098 -0.000000088 7: 1 3.400 0.011226266 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2 1: GGA AM05 0 1 Ex -0.444802181 -0.418741293 0.026060888 2 1: GGA AM05 0 1 Ec -0.066123378 -0.066892926 0.000769548 2 1: GGA AM05 0 2 Ex -0.495081983 -0.521142871 0.026060888 2 1: GGA AM05 0 2 Ec -0.053133464 -0.052363916 0.000769548 2 1: GGA AM05 0 3 Ex -0.027843105 0.048584822 0.076427927 2 1: GGA AM05 0 3 Ec 0.007193337 0.005967859 0.001225478 2 1: GGA AM05 0 4 Ex -0.058071172 -0.083433543 0.025362371 2 1: GGA AM05 0 4 Ec 0.015002834 0.015257259 0.000254425 2 1: GGA PW86 0 1 Ex -0.631278205 -0.572076758 0.059201447 2 1: GGA PW86 0 2 Ex -0.648670734 -0.707872194 0.059201460 2 1: GGA PW86 0 3 Ex -0.009631343 0.103720650 0.113351993 2 1: GGA PW86 0 4 Ex -0.020087679 -0.048806795 0.028719116 2 1: GGA B88 0 1 Ex -0.506789042 -0.452335152 0.054453890 2 1: GGA B88 0 2 Ex -0.537455658 -0.591909565 0.054453906 2 1: GGA B88 0 3 Ex -0.016982044 0.121264092 0.138246136 2 1: GGA B88 0 4 Ex -0.035418722 -0.078129003 0.042710280 2 1: GGA C09 0 1 Ex -0.769564736 -0.662908984 0.106655753 2 1: GGA 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0.017745509 0.009336470 0.008409039 2 1: GGA PBE 0 4 Ex 0.148108648 0.150518822 0.002410175 2 1: GGA RPBE 0 1 Ex -0.297830313 -0.293910685 0.003919628 2 1: GGA RPBE 0 2 Ex -0.255732927 -0.259652555 0.003919627 2 1: GGA RPBE 0 3 Ex 0.022509418 0.019876649 0.002632770 2 1: GGA RPBE 0 4 Ex 0.187869479 0.188624067 0.000754588 2 1: GGA revPBE 0 1 Ex -0.268224869 -0.243313783 0.024911087 2 1: GGA revPBE 0 2 Ex -0.236227634 -0.261138720 0.024911086 2 1: GGA revPBE 0 3 Ex 0.017108880 0.000376597 0.016732284 2 1: GGA revPBE 0 4 Ex 0.142795181 0.147590950 0.004795769 2 1: GGA LYP 0 1 Ex -1.262737235 -1.170755374 0.091981861 2 1: GGA LYP 0 1 Ec -0.210814784 -0.138985182 0.071829603 2 1: GGA LYP 0 2 Ex -1.512403399 -1.604385261 0.091981862 2 1: GGA LYP 0 2 Ec -0.200786259 -0.272615861 0.071829602 2 1: GGA LYP 0 3 Ex -0.133496177 -0.140163487 0.006667310 2 1: GGA LYP 0 3 Ec 0.005362240 -0.383754617 0.389116857 2 1: GGA LYP 0 4 Ex -1.114193936 -1.103089552 0.011104384 2 1: GGA LYP 0 4 Ec 0.044754653 0.099424062 0.054669409 2 1: GGA WC 0 1 Ex -0.245437607 -0.231042773 0.014394834 2 1: GGA WC 0 2 Ex -0.213772066 -0.228166899 0.014394833 2 1: GGA WC 0 3 Ex 0.016931524 0.007262787 0.009668737 2 1: GGA WC 0 4 Ex 0.141314921 0.144086148 0.002771228 2 1: GGA PBEJsJrLO 0 1 Ex -0.237069065 -0.221508576 0.015560489 2 1: GGA PBEJsJrLO 0 2 Ex -0.207069775 -0.222630264 0.015560488 2 1: GGA PBEJsJrLO 0 3 Ex 0.016040581 0.005588901 0.010451681 2 1: GGA PBEJsJrLO 0 4 Ex 0.133878879 0.136874513 0.002995634 2 1: GGA PBEJsJrHEG 0 1 Ex -0.227758077 -0.219185420 0.008572657 2 1: GGA PBEJsJrHEG 0 2 Ex -0.197209574 -0.205782230 0.008572656 2 1: GGA PBEJsJrHEG 0 3 Ex 0.016334245 0.010576144 0.005758101 2 1: GGA PBEJsJrHEG 0 4 Ex 0.136329875 0.137980243 0.001650368 2 1: GGA PBEGcGxLO 0 1 Ex -0.227790156 -0.210621711 0.017168445 2 1: GGA PBEGcGxLO 0 2 Ex -0.199638378 -0.216806822 0.017168444 2 1: GGA PBEGcGxLO 0 3 Ex 0.015052719 0.003521010 0.011531710 2 1: GGA PBEGcGxLO 0 4 Ex 0.125633924 0.128939115 0.003305191 2 1: GGA PBEGcGxHEG 0 1 Ex -0.221888616 -0.212175065 0.009713550 2 1: GGA PBEGcGxHEG 0 2 Ex -0.192508774 -0.202222324 0.009713550 2 1: GGA PBEGcGxHEG 0 3 Ex 0.015709364 0.009184949 0.006524414 2 1: GGA PBEGcGxHEG 0 4 Ex 0.131114450 0.132984458 0.001870008 2 1: GGA PBESOL 0 1 Ex -0.227790156 -0.210621711 0.017168445 2 1: GGA PBESOL 0 2 Ex -0.199638378 -0.216806822 0.017168444 2 1: GGA PBESOL 0 3 Ex 0.015052719 0.003521010 0.011531710 2 1: GGA PBESOL 0 4 Ex 0.125633924 0.128939115 0.003305191 2 1: GGA AM05 0 1 Ex -0.968367197 -0.911913984 0.056453213 2 1: GGA AM05 0 1 Ec -0.058223443 -0.058265866 0.000042422 2 1: GGA AM05 0 2 Ex -1.153244027 -1.209697240 0.056453214 2 1: GGA AM05 0 2 Ec -0.067834059 -0.067791637 0.000042422 2 1: GGA AM05 0 3 Ex -0.098853403 -0.108447497 0.009594094 2 1: GGA AM05 0 3 Ec -0.005138784 -0.005110290 0.000028494 2 1: GGA AM05 0 4 Ex -0.825056304 -0.817581841 0.007474463 2 1: GGA AM05 0 4 Ec -0.042889631 -0.042897798 0.000008167 2 1: GGA PW86 0 1 Ex -0.523866574 -0.495845356 0.028021218 2 1: GGA PW86 0 2 Ex -0.569868807 -0.597890025 0.028021217 2 1: GGA PW86 0 3 Ex -0.024597335 -0.042317038 0.017719703 2 1: GGA PW86 0 4 Ex -0.205295776 -0.200033244 0.005262532 2 1: GGA B88 0 1 Ex -1.262724557 -1.170744240 0.091980317 2 1: GGA B88 0 2 Ex -1.512390643 -1.604370945 0.091980303 2 1: GGA B88 0 3 Ex -0.133496135 -0.140162387 0.006666252 2 1: GGA B88 0 4 Ex -1.114193586 -1.103089499 0.011104087 2 1: GGA C09 0 1 Ex -0.203331792 -0.158396493 0.044935300 2 1: GGA C09 0 2 Ex -0.184255353 -0.229190652 0.044935299 2 1: GGA C09 0 3 Ex 0.010200148 -0.019981967 0.030182115 2 1: GGA C09 0 4 Ex 0.085133094 0.093783834 0.008650740 2 1: GGA BH 0 1 Ex -0.524964364 -0.497754174 0.027210191 2 1: GGA BH 0 2 Ex -0.568712123 -0.595922313 0.027210190 2 1: GGA BH 0 3 Ex -0.023391870 -0.040581746 0.017189876 2 1: GGA BH 0 4 Ex -0.195234656 -0.190126471 0.005108185 2 1: 1: iSpin dens gradDens 1: 1 0.453619175 -5.668613105 0.544304163 0.862539965 1: 2 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1.800 0.021174391 -0.806916840 -0.806916840 -0.000000000 7: 2 2.000 0.019255418 -0.783153757 -0.783153751 -0.000000006 6: 2 9.400 0.000000504 -0.035452601 -0.035452511 -0.000000090 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 -0.018492312 -0.000000065 6: 2 10.400 0.000000042 -0.015573224 -0.015573163 -0.000000060 6: 2 10.600 0.000000025 -0.013068736 -0.013068679 -0.000000056 6: 2 10.800 0.000000015 -0.010928714 -0.010928688 -0.000000027 6: 2 11.000 0.000000008 -0.009107337 -0.009107284 -0.000000053 6: 2 11.200 0.000000005 -0.007563161 -0.007563160 -0.000000000 6: 2 11.400 0.000000003 -0.006258998 -0.006258954 -0.000000044 6: 2 11.600 0.000000002 -0.005161710 -0.005161564 -0.000000146 6: avgDiffVxc, maxDiffVxc = 0.000000043 0.000000443 1: GGA RPBE 0 1 Ex -1.050990470 -1.093160077 0.042169607 2 1: GGA RPBE 0 2 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0.016484360 -0.036308491 0.052792851 2 1: GGA WC 0 4 Ex 0.101271999 0.117033047 0.015761048 2 1: GGA PBEJsJrLO 0 1 Ex -1.063767456 -1.091372149 0.027604693 2 1: GGA PBEJsJrLO 0 2 Ex -1.111799911 -1.084195215 0.027604696 2 1: GGA PBEJsJrLO 0 3 Ex 0.014543927 -0.040088108 0.054632035 2 1: GGA PBEJsJrLO 0 4 Ex 0.089350908 0.105663289 0.016312381 2 1: GGA PBEJsJrHEG 0 1 Ex -0.983386570 -1.008473349 0.025086779 2 1: GGA PBEJsJrHEG 0 2 Ex -1.069380369 -1.044293587 0.025086782 2 1: GGA PBEJsJrHEG 0 3 Ex 0.026038384 -0.023533397 0.049571782 2 1: GGA PBEJsJrHEG 0 4 Ex 0.159967339 0.174779267 0.014811928 2 1: GGA PBEGcGxLO 0 1 Ex -1.066658168 -1.090099050 0.023440882 2 1: GGA PBEGcGxLO 0 2 Ex -1.118052047 -1.094611162 0.023440885 2 1: GGA PBEGcGxLO 0 3 Ex 0.015561745 -0.030895772 0.046457517 2 1: GGA PBEGcGxLO 0 4 Ex 0.095603895 0.109466511 0.013862617 2 1: GGA PBEGcGxHEG 0 1 Ex -0.985624273 -1.007260260 0.021635987 2 1: GGA PBEGcGxHEG 0 2 Ex -1.073811141 -1.052175151 0.021635990 2 1: GGA PBEGcGxHEG 0 3 Ex 0.026702432 -0.016080771 0.042783203 2 1: GGA PBEGcGxHEG 0 4 Ex 0.164046930 0.176826337 0.012779407 2 1: GGA PBESOL 0 1 Ex -1.066658168 -1.090099050 0.023440882 2 1: GGA PBESOL 0 2 Ex -1.118052047 -1.094611162 0.023440885 2 1: GGA PBESOL 0 3 Ex 0.015561745 -0.030895772 0.046457517 2 1: GGA PBESOL 0 4 Ex 0.095603895 0.109466511 0.013862617 2 1: GGA AM05 0 1 Ex -0.980491534 -0.997255739 0.016764205 2 1: GGA AM05 0 1 Ec -0.113488088 -0.112633036 0.000855052 2 1: GGA AM05 0 2 Ex -1.076989137 -1.060224931 0.016764205 2 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 1: GGA AM05 0 4 Ex 0.179506720 0.198874085 0.019367364 2 1: GGA AM05 0 4 Ec -0.049909738 -0.050414177 0.000504439 2 1: GGA PW86 0 1 Ex -1.153882449 -1.201098506 0.047216057 2 1: GGA PW86 0 2 Ex -1.145843034 -1.098626973 0.047216061 2 1: GGA PW86 0 3 Ex -0.002434285 -0.117775650 0.115341365 2 1: GGA PW86 0 4 Ex -0.014955078 0.016510404 0.031465482 2 1: GGA B88 0 1 Ex -1.070948205 -1.117115903 0.046167698 2 1: GGA B88 0 2 Ex -1.111849721 -1.065682018 0.046167703 2 1: GGA B88 0 3 Ex 0.012384723 -0.169284368 0.181669091 2 1: GGA B88 0 4 Ex 0.076085797 0.118065873 0.041980076 2 1: GGA C09 0 1 Ex -1.229609165 -1.249629218 0.020020054 2 1: GGA C09 0 2 Ex -1.216769695 -1.196749639 0.020020057 2 1: GGA C09 0 3 Ex -0.003887711 -0.043380697 0.039492986 2 1: GGA C09 0 4 Ex -0.023884231 -0.012074721 0.011809510 2 1: GGA BH 0 1 Ex -1.173368711 -1.197153914 0.023785203 2 1: GGA BH 0 2 Ex -1.181004782 -1.157219575 0.023785207 2 1: GGA BH 0 3 Ex 0.002312155 -0.066287300 0.068599455 2 1: GGA BH 0 4 Ex 0.014204768 0.031764049 0.017559281 2 1: 1: iSpin dens gradDens 1: 1 0.376353318 -1.063186643 -4.611113539 0.845638578 1: 2 0.644395988 0.995279702 0.015298885 -0.016252449 1: 3 0.052220327 -1.802581303 0.693751194 -4.681504306 1: 4 -0.154745262 1.953957203 -5.034660607 -3.888737571 1: GGA PW91 0 1 Ex -1.665780435 -1.756686707 0.090906271 2 1: GGA PW91 0 2 Ex -1.177614483 -1.086708230 0.090906253 2 1: GGA PW91 0 3 Ex 0.095104954 0.225266450 0.130161496 2 1: GGA PW91 0 4 Ex -0.281825906 -0.159169776 0.122656129 2 1: GGA PBE 0 1 Ex -1.218515853 -1.380791948 0.162276094 2 1: GGA PBE 0 2 Ex -1.068651132 -0.906375056 0.162276076 2 1: GGA PBE 0 3 Ex 0.029196787 0.210566892 0.181370105 2 1: GGA PBE 0 4 Ex -0.086519268 0.115229487 0.201748755 2 1: GGA RPBE 0 1 Ex -1.397627318 -1.566263965 0.168636647 2 1: GGA RPBE 0 2 Ex -1.092867760 -0.924231132 0.168636628 2 1: GGA RPBE 0 3 Ex 0.059373546 0.254805174 0.195431628 2 1: GGA RPBE 0 4 Ex -0.175942500 0.036060183 0.212002684 2 1: GGA revPBE 0 1 Ex -1.294890969 -1.488472552 0.193581583 2 1: GGA revPBE 0 2 Ex -1.074332967 -0.880751405 0.193581562 2 1: GGA revPBE 0 3 Ex 0.042969319 0.252885462 0.209916143 2 1: GGA revPBE 0 4 Ex -0.127331614 0.111163250 0.238494864 2 1: GGA LYP 0 1 Ex -0.863844163 -1.119812534 0.255968371 2 1: GGA LYP 0 1 Ec -0.253251010 -0.231216198 0.022034813 2 1: GGA LYP 0 2 Ex -0.996344646 -0.740376276 0.255968370 2 1: GGA LYP 0 2 Ec -0.113415508 -0.135450320 0.022034813 2 1: GGA LYP 0 3 Ex -0.025813870 0.219727557 0.245541427 2 1: GGA LYP 0 3 Ec 0.027242885 0.027406343 0.000163458 2 1: GGA LYP 0 4 Ex 0.076494619 0.381043371 0.304548752 2 1: GGA LYP 0 4 Ec -0.080729242 -0.099757929 0.019028687 2 1: GGA WC 0 1 Ex -1.209330901 -1.335326543 0.125995643 2 1: GGA WC 0 2 Ex -1.093288063 -0.967292439 0.125995624 2 1: GGA WC 0 3 Ex 0.022607576 0.161364833 0.138757257 2 1: GGA WC 0 4 Ex -0.066993361 0.088953595 0.155946956 2 1: GGA PBEJsJrLO 0 1 Ex -1.159767487 -1.289668575 0.129901089 2 1: GGA PBEJsJrLO 0 2 Ex -1.069583293 -0.939682222 0.129901070 2 1: GGA PBEJsJrLO 0 3 Ex 0.017569770 0.159205931 0.141636161 2 1: GGA PBEJsJrLO 0 4 Ex -0.052064758 0.108236130 0.160300888 2 1: GGA PBEJsJrHEG 0 1 Ex -1.113167924 -1.224855985 0.111688061 2 1: GGA PBEJsJrHEG 0 2 Ex -1.066066288 -0.954378244 0.111688043 2 1: GGA PBEJsJrHEG 0 3 Ex 0.009176386 0.134033209 0.124856824 2 1: GGA PBEJsJrHEG 0 4 Ex -0.027192518 0.111672130 0.138864648 2 1: GGA PBEGcGxLO 0 1 Ex -1.123170186 -1.238615490 0.115445305 2 1: GGA PBEGcGxLO 0 2 Ex -1.068682229 -0.953236942 0.115445287 2 1: GGA PBEGcGxLO 0 3 Ex 0.010615396 0.134214135 0.123598740 2 1: GGA PBEGcGxLO 0 4 Ex -0.031456757 0.110237399 0.141694156 2 1: GGA PBEGcGxHEG 0 1 Ex -1.092090300 -1.190926644 0.098836344 2 1: GGA PBEGcGxHEG 0 2 Ex -1.066666302 -0.967829975 0.098836327 2 1: GGA PBEGcGxHEG 0 3 Ex 0.004953127 0.114105060 0.109151933 2 1: GGA PBEGcGxHEG 0 4 Ex -0.014677675 0.107756623 0.122434299 2 1: GGA PBESOL 0 1 Ex -1.123170186 -1.238615490 0.115445305 2 1: GGA PBESOL 0 2 Ex -1.068682229 -0.953236942 0.115445287 2 1: GGA PBESOL 0 3 Ex 0.010615396 0.134214135 0.123598740 2 1: GGA PBESOL 0 4 Ex -0.031456757 0.110237399 0.141694156 2 1: GGA AM05 0 1 Ex -0.774045081 -0.885458176 0.111413095 2 1: GGA AM05 0 1 Ec -0.082798175 -0.076898025 0.005900150 2 1: GGA AM05 0 2 Ex -1.008120349 -0.896707254 0.111413095 2 1: GGA AM05 0 2 Ec -0.068136885 -0.074037035 0.005900150 2 1: GGA AM05 0 3 Ex -0.045602766 0.048900586 0.094503352 2 1: GGA AM05 0 3 Ec 0.002856326 -0.003975501 0.006831827 2 1: GGA AM05 0 4 Ex 0.135135345 0.263518776 0.128383431 2 1: GGA AM05 0 4 Ec -0.008464194 -0.015879647 0.007415453 2 1: GGA PW86 0 1 Ex -1.066620130 -1.301644843 0.235024713 2 1: GGA PW86 0 2 Ex -1.009992828 -0.774968135 0.235024693 2 1: GGA PW86 0 3 Ex 0.011032185 0.261669444 0.250637259 2 1: GGA PW86 0 4 Ex -0.032691835 0.255437725 0.288129559 2 1: GGA B88 0 1 Ex -0.863366688 -1.119247290 0.255880602 2 1: GGA B88 0 2 Ex -0.995680782 -0.739800201 0.255880581 2 1: GGA B88 0 3 Ex -0.025777557 0.219674431 0.245451988 2 1: GGA B88 0 4 Ex 0.076387013 0.380829556 0.304442543 2 1: GGA C09 0 1 Ex -1.136146237 -1.267915024 0.131768787 2 1: GGA C09 0 2 Ex -1.076184699 -0.944415931 0.131768767 2 1: GGA C09 0 3 Ex 0.011681764 0.139540504 0.127858741 2 1: GGA C09 0 4 Ex -0.034616742 0.122652386 0.157269128 2 1: GGA BH 0 1 Ex -1.105824030 -1.234500979 0.128676949 2 1: GGA BH 0 2 Ex -1.066137590 -0.937460659 0.128676930 2 1: GGA BH 0 3 Ex 0.007731750 0.135726758 0.127995008 2 1: GGA BH 0 4 Ex -0.022911608 0.131725737 0.154637344 2 1: 1: iSpin dens gradDens 1: 1 0.522511616 3.348348518 -1.948929348 7.294121393 1: 2 1.451975989 -8.618380343 1.281225316 -5.697190800 1: 3 0.168447636 7.968499108 -1.664332427 9.140289364 1: 4 -0.121690566 -8.299458434 -5.002063811 1.266576824 1: GGA PW91 0 1 Ex -0.931258491 -0.804007936 0.127250555 2 1: GGA PW91 0 2 Ex -1.362544995 -1.489795537 0.127250542 2 1: GGA PW91 0 3 Ex -0.078162428 0.331774953 0.409937380 2 1: GGA PW91 0 4 Ex 0.056466391 0.137948101 0.081481710 2 1: GGA PBE 0 1 Ex -0.953146068 -0.836211976 0.116934092 2 1: GGA PBE 0 2 Ex -1.364472804 -1.481406882 0.116934078 2 1: GGA PBE 0 3 Ex -0.074545102 0.304705126 0.379250227 2 1: GGA PBE 0 4 Ex 0.053853149 0.132255035 0.078401886 2 1: GGA RPBE 0 1 Ex -0.864712493 -0.734551468 0.130161025 2 1: GGA RPBE 0 2 Ex -1.358884455 -1.489045467 0.130161012 2 1: GGA RPBE 0 3 Ex -0.089559214 0.374736146 0.464295360 2 1: GGA RPBE 0 4 Ex 0.064699700 0.210310325 0.145610626 2 1: GGA revPBE 0 1 Ex -0.863768077 -0.735477071 0.128291006 2 1: GGA revPBE 0 2 Ex -1.359294926 -1.487585919 0.128290993 2 1: GGA revPBE 0 3 Ex -0.089804761 0.364926892 0.454731653 2 1: GGA revPBE 0 4 Ex 0.064877089 0.204390893 0.139513804 2 1: GGA LYP 0 1 Ex -0.876247866 -0.743890908 0.132356958 2 1: GGA LYP 0 1 Ec -0.121279256 -0.102906103 0.018373153 2 1: GGA LYP 0 2 Ex -1.361264612 -1.493621569 0.132356957 2 1: GGA LYP 0 2 Ec -0.035817283 -0.054190436 0.018373153 2 1: GGA LYP 0 3 Ex -0.087900006 0.358734345 0.446634352 2 1: GGA LYP 0 3 Ec 0.015488348 0.037360693 0.021872345 2 1: GGA LYP 0 4 Ex 0.063501049 0.176278587 0.112777538 2 1: GGA LYP 0 4 Ec -0.011189150 -0.051079264 0.039890115 2 1: GGA WC 0 1 Ex -0.897072577 -0.788700804 0.108371773 2 1: GGA WC 0 2 Ex -1.365979036 -1.474350796 0.108371760 2 1: GGA WC 0 3 Ex -0.084980325 0.271980367 0.356960692 2 1: GGA WC 0 4 Ex 0.061391802 0.141639064 0.080247262 2 1: GGA PBEJsJrLO 0 1 Ex -0.912659716 -0.825376843 0.087282873 2 1: GGA PBEJsJrLO 0 2 Ex -1.371888845 -1.459171705 0.087282860 2 1: GGA PBEJsJrLO 0 3 Ex -0.083226494 0.222363017 0.305589511 2 7: 2 2.200 0.017336125 -0.757597743 -0.757597747 0.000000004 7: 2 2.400 0.015452834 -0.730277351 -0.730277355 0.000000004 7: 2 2.600 0.013637077 -0.701421448 -0.701421447 -0.000000001 7: 2 2.800 0.011914930 -0.671294327 -0.671294326 -0.000000001 7: 2 3.000 0.010306678 -0.640127830 -0.640127830 0.000000000 7: 2 3.200 0.008826792 -0.608140908 -0.608140904 -0.000000004 7: 2 3.400 0.007484177 -0.575559240 -0.575559241 0.000000000 3/9 Test #6: libgridxc_test_libxc ............. Passed 0.06 sec 7: 2 3.600 0.006282640 -0.542620903 -0.542620904 0.000000001 7: 2 3.800 0.005221523 -0.509578436 -0.509578436 -0.000000000 1: GGA PBEJsJrLO 0 4 Ex 0.060124793 0.149800368 0.089675576 2 1: GGA PBEJsJrHEG 0 1 Ex -0.964864754 -0.884324303 0.080540451 2 1: GGA PBEJsJrHEG 0 2 Ex -1.374943001 -1.455483438 0.080540438 2 1: GGA PBEJsJrHEG 0 3 Ex -0.074318837 0.186662799 0.260981636 2 1: GGA PBEJsJrHEG 0 4 Ex 0.053689690 0.107366827 0.053677138 2 1: GGA PBEGcGxLO 0 1 Ex -0.901149359 -0.827021354 0.074128005 2 1: GGA PBEGcGxLO 0 2 Ex -1.375318817 -1.449446810 0.074127993 2 1: GGA PBEGcGxLO 0 3 Ex -0.085934143 0.183401278 0.269335421 2 1: GGA PBEGcGxLO 0 4 Ex 0.062080862 0.151810464 0.089729602 2 1: GGA PBEGcGxHEG 0 1 Ex -0.947280285 -0.878595496 0.068684790 2 1: GGA PBEGcGxHEG 0 2 Ex -1.377877435 -1.446562212 0.068684777 2 1: GGA PBEGcGxHEG 0 3 Ex -0.078037495 0.154342658 0.232380154 2 1: GGA PBEGcGxHEG 0 4 Ex 0.056376137 0.115738637 0.059362500 2 1: GGA PBESOL 0 1 Ex -0.901149359 -0.827021354 0.074128005 2 1: GGA PBESOL 0 2 Ex -1.375318817 -1.449446810 0.074127993 2 1: GGA PBESOL 0 3 Ex -0.085934143 0.183401278 0.269335421 2 1: GGA PBESOL 0 4 Ex 0.062080862 0.151810464 0.089729602 2 1: GGA AM05 0 1 Ex -0.848553718 -0.827630908 0.020922809 2 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 1: GGA AM05 0 3 Ex -0.098221535 0.036740664 0.134962199 2 1: GGA AM05 0 3 Ec 0.006857818 -0.014586824 0.021444642 2 1: GGA AM05 0 4 Ex 0.070957566 0.177872678 0.106915112 2 1: GGA AM05 0 4 Ec -0.004954250 0.000761518 0.005715768 2 1: GGA PW86 0 1 Ex -1.003132451 -0.875517936 0.127614515 2 1: GGA PW86 0 2 Ex -1.351446158 -1.479060660 0.127614502 2 1: GGA PW86 0 3 Ex -0.063125196 0.330727830 0.393853026 2 1: GGA PW86 0 4 Ex 0.045603138 0.103430467 0.057827329 2 1: GGA B88 0 1 Ex -0.875703545 -0.743426937 0.132276608 2 1: GGA B88 0 2 Ex -1.359816324 -1.492092919 0.132276595 2 1: GGA B88 0 3 Ex -0.087736179 0.358671111 0.446407290 2 1: GGA B88 0 4 Ex 0.063382696 0.176152793 0.112770096 2 1: GGA C09 0 1 Ex -0.808993768 -0.742571384 0.066422383 2 1: GGA C09 0 2 Ex -1.375345706 -1.441768076 0.066422370 2 1: GGA C09 0 3 Ex -0.102640454 0.178280709 0.280921163 2 1: GGA C09 0 4 Ex 0.074149897 0.209344337 0.135194439 2 1: GGA BH 0 1 Ex -0.718784573 -0.643378840 0.075405733 2 1: GGA BH 0 2 Ex -1.370662366 -1.446068086 0.075405720 2 1: GGA BH 0 3 Ex -0.118140379 0.223528845 0.341669223 2 1: GGA BH 0 4 Ex 0.085347411 0.270323980 0.184976569 2 1: 1: iSpin dens gradDens 1: 1 0.036487630 0.366673642 0.275484249 0.057500763 1: 2 0.045163246 -0.392901074 0.379663696 0.072582468 1: 3 -0.010202296 0.055585690 0.082666738 0.396233963 1: 4 -0.006548443 0.325943013 -0.364291968 -0.266720325 1: GGA PW91 0 1 Ex -0.883408966 -1.010839277 0.127430311 2 1: GGA PW91 0 2 Ex -0.818971287 -0.691540979 0.127430307 2 1: GGA PW91 0 3 Ex -0.075777018 -0.139442948 0.063665929 2 1: GGA PW91 0 4 Ex -0.048638216 0.134963728 0.183601944 2 1: GGA PBE 0 1 Ex -0.624497347 -0.564143567 0.060353780 2 1: GGA PBE 0 2 Ex -0.634058624 -0.694412405 0.060353781 2 1: GGA PBE 0 3 Ex 0.011243810 -0.057760031 0.069003841 2 1: GGA PBE 0 4 Ex 0.007216949 0.074743622 0.067526673 2 1: GGA RPBE 0 1 Ex -0.710782881 -0.686404091 0.024378790 2 1: GGA RPBE 0 2 Ex -0.742907104 -0.767285895 0.024378792 2 1: GGA RPBE 0 3 Ex 0.037777241 0.000677410 0.037099832 2 1: GGA RPBE 0 4 Ex 0.024247690 0.065899271 0.041651582 2 1: GGA revPBE 0 1 Ex -0.682628221 -0.562562240 0.120065980 2 1: GGA revPBE 0 2 Ex -0.663680060 -0.783746041 0.120065981 2 1: GGA revPBE 0 3 Ex -0.022282540 -0.154420728 0.132138189 2 1: GGA revPBE 0 4 Ex -0.014302265 0.112031559 0.126333824 2 1: GGA LYP 0 1 Ex -0.417011701 -0.050161240 0.366850461 2 1: GGA LYP 0 1 Ec -0.186402991 -0.201023201 0.014620209 2 1: GGA LYP 0 2 Ex -0.427774830 -0.794625291 0.366850461 2 1: GGA LYP 0 2 Ec -0.189854800 -0.175234590 0.014620209 2 1: GGA LYP 0 3 Ex 0.012657157 -0.201427472 0.214084628 2 1: GGA LYP 0 3 Ec 0.004059236 -0.288680487 0.292739723 2 1: GGA LYP 0 4 Ex 0.008124119 0.098653725 0.090529606 2 1: GGA LYP 0 4 Ec 0.002605460 0.468370683 0.465765222 2 1: GGA WC 0 1 Ex -0.610625431 -0.540613515 0.070011916 2 1: GGA WC 0 2 Ex -0.610507917 -0.680519834 0.070011917 2 1: GGA WC 0 3 Ex -0.000138193 -0.083477500 0.083339307 2 1: GGA WC 0 4 Ex -0.000088701 0.083374514 0.083463215 2 1: GGA PBEJsJrLO 0 1 Ex -0.591288759 -0.516311251 0.074977508 2 1: GGA PBEJsJrLO 0 2 Ex -0.591474279 -0.666451788 0.074977509 2 1: GGA PBEJsJrLO 0 3 Ex 0.000218166 -0.082854916 0.083073082 2 1: GGA PBEJsJrLO 0 4 Ex 0.000140032 0.079899177 0.079759145 2 1: GGA PBEJsJrHEG 0 1 Ex -0.556509652 -0.515181548 0.041328105 2 1: GGA PBEJsJrHEG 0 2 Ex -0.572814122 -0.614142228 0.041328106 2 1: GGA PBEJsJrHEG 0 3 Ex 0.019173628 -0.028091409 0.047265037 2 1: GGA PBEJsJrHEG 0 4 Ex 0.012306780 0.058567939 0.046261159 2 1: GGA 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1: GGA PBEGcGxHEG 0 3 Ex 0.017333684 6.219511789 6.202178105 2 1: GGA PBEGcGxHEG 0 4 Ex 0.019410069 -2.982715878 3.002125947 2 1: GGA PBESOL 0 1 Ex -0.650187710 0.661495627 1.311683337 2 1: GGA PBESOL 0 2 Ex -0.514858134 -1.826541481 1.311683347 2 1: GGA PBESOL 0 3 Ex 0.020110106 9.399587183 9.379477078 2 1: GGA PBESOL 0 4 Ex 0.022519076 -4.412276058 4.434795134 2 1: GGA AM05 0 1 Ex -0.454047209 1.518201096 1.972248305 2 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 1: GGA AM05 0 3 Ex -0.000774662 13.006759650 13.007534312 2 1: GGA AM05 0 3 Ec -0.000359639 -0.070913215 0.070553575 2 1: GGA AM05 0 4 Ex -0.000867458 -5.690760233 5.689892775 2 1: GGA AM05 0 4 Ec -0.000402720 0.036416384 0.036819105 2 1: GGA PW86 0 1 Ex -0.668994857 0.959637010 1.628631867 2 1: GGA PW86 0 2 Ex -0.581404109 -2.210035988 1.628631879 2 1: GGA PW86 0 3 Ex 0.013016070 11.264533587 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0.145952348 2 1: GGA LYP 0 1 Ec -0.195474817 -0.158081876 0.037392941 2 1: GGA LYP 0 2 Ex -1.180177388 -1.034225040 0.145952348 2 1: GGA LYP 0 2 Ec -0.097922715 -0.135315655 0.037392941 2 1: GGA LYP 0 3 Ex -0.068843745 -0.272058250 0.203214506 2 1: GGA LYP 0 3 Ec 0.047175167 0.038900457 0.008274710 2 1: GGA LYP 0 4 Ex 0.049970111 -0.022096307 0.072066417 2 1: GGA LYP 0 4 Ec -0.034242012 -0.098906461 0.064664449 2 1: GGA WC 0 1 Ex -1.394819120 -1.443456190 0.048637069 2 1: GGA WC 0 2 Ex -1.301268619 -1.252631559 0.048637060 2 1: GGA WC 0 3 Ex 0.045240035 -0.067142635 0.112382670 2 1: GGA WC 0 4 Ex -0.032837400 -0.118385759 0.085548359 2 1: GGA PBEJsJrLO 0 1 Ex -1.344090312 -1.396101248 0.052010935 2 1: GGA PBEJsJrLO 0 2 Ex -1.258591780 -1.206580855 0.052010925 2 1: GGA PBEJsJrLO 0 3 Ex 0.041346188 -0.081295821 0.122642009 2 1: GGA PBEJsJrLO 0 4 Ex -0.030011058 -0.124887790 0.094876732 2 1: GGA PBEJsJrHEG 0 1 Ex -1.337859738 -1.370989736 0.033129998 2 1: GGA PBEJsJrHEG 0 2 Ex -1.298847429 -1.265717442 0.033129987 2 1: GGA PBEJsJrHEG 0 3 Ex 0.018865941 -0.074517061 0.093383002 2 1: GGA PBEJsJrHEG 0 4 Ex -0.013693810 -0.095155417 0.081461607 2 1: GGA PBEGcGxLO 0 1 Ex -1.290955652 -1.344618595 0.053662942 2 1: GGA PBEGcGxLO 0 2 Ex -1.248846892 -1.195183959 0.053662932 2 1: GGA PBEGcGxLO 0 3 Ex 0.020363352 -0.093865903 0.114229255 2 1: GGA PBEGcGxLO 0 4 Ex -0.014780703 -0.095713996 0.080933293 2 1: GGA PBEGcGxHEG 0 1 Ex -1.301990227 -1.336580368 0.034590142 2 1: GGA PBEGcGxHEG 0 2 Ex -1.284902279 -1.250312148 0.034590131 2 1: GGA PBEGcGxHEG 0 3 Ex 0.008263551 -0.080469775 0.088733326 2 1: GGA PBEGcGxHEG 0 4 Ex -0.005998084 -0.078973937 0.072975853 2 1: GGA PBESOL 0 1 Ex -1.290955652 -1.344618595 0.053662942 2 1: GGA PBESOL 0 2 Ex -1.248846892 -1.195183959 0.053662932 2 1: GGA PBESOL 0 3 Ex 0.020363352 -0.093865903 0.114229255 2 1: GGA PBESOL 0 4 Ex -0.014780703 -0.095713996 0.080933293 2 1: GGA AM05 0 1 Ex -0.932339800 -1.026189818 0.093850018 2 1: GGA AM05 0 1 Ec -0.085167829 -0.084871105 0.000296724 2 1: GGA AM05 0 2 Ex -1.154092906 -1.060242888 0.093850018 2 1: GGA AM05 0 2 Ec -0.068003632 -0.068300356 0.000296724 2 1: GGA AM05 0 3 Ex -0.107237462 -0.220940916 0.113703454 2 1: GGA AM05 0 3 Ec 0.008300424 0.009599681 0.001299257 2 1: GGA AM05 0 4 Ex 0.077838123 0.054873754 0.022964368 2 1: GGA AM05 0 4 Ec -0.006024848 -0.004657532 0.001367316 2 1: GGA PW86 0 1 Ex -1.308842987 -1.386035791 0.077192803 2 1: GGA PW86 0 2 Ex -1.319015323 -1.241822531 0.077192792 2 1: GGA PW86 0 3 Ex -0.004919234 -0.151774382 0.146855148 2 1: GGA PW86 0 4 Ex 0.003570617 -0.088794198 0.092364815 2 1: GGA B88 0 1 Ex -1.036913684 -1.182803531 0.145889847 2 1: GGA B88 0 2 Ex -1.178897821 -1.033007982 0.145889839 2 1: GGA B88 0 3 Ex -0.068662030 -0.271763215 0.203101184 2 1: GGA B88 0 4 Ex 0.049838214 -0.022161132 0.071999346 2 1: GGA C09 0 1 Ex -1.063133662 -1.179039689 0.115906027 2 1: GGA C09 0 2 Ex -1.160065253 -1.044159235 0.115906018 2 1: GGA C09 0 3 Ex -0.046875095 -0.203118731 0.156243637 2 1: GGA C09 0 4 Ex 0.034024205 -0.016130036 0.050154240 2 1: GGA BH 0 1 Ex -1.305890082 -1.382037904 0.076147821 2 1: GGA BH 0 2 Ex -1.173362822 -1.097215009 0.076147813 2 1: GGA BH 0 3 Ex 0.064088785 -0.084036473 0.148125257 2 1: GGA BH 0 4 Ex -0.046518731 -0.142121892 0.095603160 2 1: 1: iSpin dens gradDens 1: 1 0.006264646 -0.050713526 -0.045842509 -0.053065701 1: 2 0.004610547 -0.038386926 -0.053360174 -0.028485090 1: 3 -0.002799577 -0.018535931 -0.000404846 0.000770491 1: 4 -0.001171482 0.043569316 0.046488698 -0.033526436 1: GGA PW91 0 1 Ex -0.414466124 -0.406941912 0.007524212 2 1: GGA PW91 0 2 Ex -0.258562064 -0.266086286 0.007524221 2 1: GGA PW91 0 3 Ex 0.263868923 0.325946308 0.062077384 2 1: GGA PW91 0 4 Ex 0.110415827 -0.032623117 0.143038944 2 1: GGA PBE 0 1 Ex -0.366718905 -0.367611549 0.000892644 2 1: GGA PBE 0 2 Ex -0.336289036 -0.335396408 0.000892628 2 1: GGA PBE 0 3 Ex 0.051502808 0.044621784 0.006881023 2 1: GGA PBE 0 4 Ex 0.021551326 0.037365234 0.015813909 2 1: GGA RPBE 0 1 Ex -0.398068185 -0.398070767 0.000002582 2 1: GGA RPBE 0 2 Ex -0.355195924 -0.355193359 0.000002565 2 1: GGA RPBE 0 3 Ex 0.072561660 0.072542433 0.000019228 2 1: GGA RPBE 0 4 Ex 0.030363393 0.030407530 0.000044137 2 1: GGA revPBE 0 1 Ex -0.425452141 -0.427400243 0.001948102 2 1: GGA revPBE 0 2 Ex -0.399755741 -0.397807660 0.001948082 2 1: GGA revPBE 0 3 Ex 0.043491372 0.028430666 0.015060706 2 1: GGA revPBE 0 4 Ex 0.018198944 0.052815313 0.034616369 2 1: GGA LYP 0 1 Ex -0.284614100 -0.261890689 0.022723411 2 1: GGA LYP 0 1 Ec -1.661739002 -1.805519841 0.143780839 2 1: GGA LYP 0 2 Ex -0.295953364 -0.318676775 0.022723411 2 1: GGA LYP 0 2 Ec -2.351662340 -2.207881500 0.143780840 2 1: GGA LYP 0 3 Ex -0.019191801 -0.061002477 0.041810676 2 1: GGA LYP 0 3 Ec -1.167701017 -1.582668498 0.414967482 2 1: GGA LYP 0 4 Ex -0.008030800 0.107929696 0.115960496 2 1: GGA LYP 0 4 Ec -0.488623942 0.401547485 0.890171427 2 1: GGA WC 0 1 Ex -0.364468094 -0.365357441 0.000889347 2 1: GGA WC 0 2 Ex -0.334614775 -0.333725444 0.000889331 2 1: GGA WC 0 3 Ex 0.050526992 0.043552166 0.006974826 2 1: GGA WC 0 4 Ex 0.021142996 0.037183399 0.016040403 2 1: GGA PBEJsJrLO 0 1 Ex -0.355237196 -0.356435302 0.001198105 2 1: GGA PBEJsJrLO 0 2 Ex -0.329315341 -0.328117252 0.001198089 2 1: GGA PBEJsJrLO 0 3 Ex 0.043872957 0.034615337 0.009257620 2 1: GGA PBEJsJrLO 0 4 Ex 0.018358618 0.039636406 0.021277788 2 1: GGA PBEJsJrHEG 0 1 Ex -0.321025321 -0.321636107 0.000610786 2 1: GGA PBEJsJrHEG 0 2 Ex -0.292650100 -0.292039328 0.000610771 2 1: GGA PBEJsJrHEG 0 3 Ex 0.048025299 0.043317116 0.004708183 2 1: GGA PBEJsJrHEG 0 4 Ex 0.020096164 0.030916461 0.010820297 2 1: GGA PBEGcGxLO 0 1 Ex -0.347729282 -0.349119615 0.001390333 2 1: GGA PBEGcGxLO 0 2 Ex -0.324736245 -0.323345928 0.001390316 2 1: GGA PBEGcGxLO 0 3 Ex 0.038915909 0.028153869 0.010762040 2 1: GGA PBEGcGxLO 0 4 Ex 0.016284344 0.041021645 0.024737301 2 1: GGA PBEGcGxHEG 0 1 Ex -0.316963927 -0.317683924 0.000719997 2 1: GGA PBEGcGxHEG 0 2 Ex -0.290186190 -0.289466207 0.000719983 2 1: GGA PBEGcGxHEG 0 3 Ex 0.045321543 0.039765002 0.005556541 2 1: GGA PBEGcGxHEG 0 4 Ex 0.018964778 0.031735359 0.012770580 2 1: GGA PBESOL 0 1 Ex -0.347729282 -0.349119615 0.001390333 2 1: GGA PBESOL 0 2 Ex -0.324736245 -0.323345928 0.001390316 2 1: GGA PBESOL 0 3 Ex 0.038915909 0.028153869 0.010762040 2 1: GGA PBESOL 0 4 Ex 0.016284344 0.041021645 0.024737301 2 1: GGA AM05 0 1 Ex -0.238721633 -0.224625880 0.014095753 2 1: GGA AM05 0 1 Ec -0.036168923 -0.036164740 0.000004183 2 1: GGA AM05 0 2 Ex -0.247446246 -0.261541998 0.014095753 2 1: GGA AM05 0 2 Ec -0.043531974 -0.043536157 0.000004183 2 1: GGA AM05 0 3 Ex -0.014766480 -0.044681033 0.029914553 2 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 0.08 sec 1: GGA PW86 0 1 Ex -0.351966084 -0.348600767 0.003365317 2 1: GGA PW86 0 2 Ex -0.353773124 -0.357138465 0.003365341 2 1: GGA PW86 0 3 Ex -0.003058431 -0.027497879 0.024439448 2 1: GGA PW86 0 4 Ex -0.001279799 0.059500839 0.060780638 2 1: GGA B88 0 1 Ex -0.284603582 -0.261880259 0.022723324 2 1: GGA B88 0 2 Ex -0.295943875 -0.318667239 0.022723364 2 1: GGA B88 0 3 Ex -0.019193540 -0.061002668 0.041809128 2 1: GGA B88 0 4 Ex -0.008031528 0.107925194 0.115956722 2 1: GGA C09 0 1 Ex -0.435654795 -0.437557034 0.001902239 2 1: GGA C09 0 2 Ex -0.407170231 -0.405268013 0.001902218 2 1: GGA C09 0 3 Ex 0.048210363 0.033997825 0.014212539 2 1: GGA C09 0 4 Ex 0.020173604 0.052795423 0.032621819 2 1: GGA BH 0 1 Ex -0.357682377 -0.354295471 0.003386906 2 1: GGA BH 0 2 Ex -0.356437320 -0.359824250 0.003386929 2 1: GGA BH 0 3 Ex 0.002107268 -0.021087600 0.023194868 2 1: GGA BH 0 4 Ex 0.000881785 0.058703400 0.057821614 2 1: 1: iSpin dens gradDens 1: 1 1.329543175 -2.718844620 2.108228695 -5.750575277 1: 2 1.036661424 -2.948366430 -3.408590132 7.756384047 1: 3 0.033580387 1.887861733 4.947897896 1.321180513 1: 4 0.133980128 -6.011190247 1.403576936 2.832298879 1: GGA PW91 0 1 Ex -1.283892290 -1.398635074 0.114742784 2 1: GGA PW91 0 2 Ex -1.167522968 -1.052780180 0.114742787 2 1: GGA PW91 0 3 Ex -0.013342336 -0.088624121 0.075281785 2 1: GGA PW91 0 4 Ex -0.053233691 0.091049114 0.144282805 2 1: GGA PBE 0 1 Ex -1.274692518 -1.395555779 0.120863260 2 1: GGA PBE 0 2 Ex -1.154555467 -1.033692204 0.120863264 2 1: GGA PBE 0 3 Ex -0.013774326 -0.093033392 0.079259066 2 1: GGA PBE 0 4 Ex -0.054957256 0.097012112 0.151969368 2 1: GGA RPBE 0 1 Ex -1.259742281 -1.402860476 0.143118195 2 1: GGA RPBE 0 2 Ex -1.130687950 -0.987569752 0.143118198 2 1: GGA RPBE 0 3 Ex -0.014796737 -0.108582921 0.093786184 2 1: GGA RPBE 0 4 Ex -0.059036508 0.120898637 0.179935145 2 1: GGA revPBE 0 1 Ex -1.263991282 -1.400896565 0.136905283 2 1: GGA revPBE 0 2 Ex -1.137362403 -1.000457117 0.136905286 2 1: GGA revPBE 0 3 Ex -0.014518647 -0.104248740 0.089730093 2 1: GGA revPBE 0 4 Ex -0.057926973 0.114200824 0.172127797 2 1: GGA LYP 0 1 Ex -1.283057245 -1.401317865 0.118260620 2 1: GGA LYP 0 1 Ec -0.055985497 -0.040541935 0.015443562 2 1: GGA LYP 0 2 Ex -1.164861522 -1.046600901 0.118260621 2 1: GGA LYP 0 2 Ec -0.061604040 -0.077047602 0.015443562 2 1: GGA LYP 0 3 Ex -0.013551742 -0.091128905 0.077577163 2 1: GGA LYP 0 3 Ec 0.000644195 0.010646718 0.010002524 2 1: GGA LYP 0 4 Ex -0.054069187 0.094633909 0.148703095 2 1: GGA LYP 0 4 Ec 0.002570229 -0.016816656 0.019386885 2 1: GGA WC 0 1 Ex -1.303351927 -1.387962401 0.084610474 2 1: GGA WC 0 2 Ex -1.193725291 -1.109114815 0.084610477 2 1: GGA WC 0 3 Ex -0.012569253 -0.068128156 0.055558903 2 1: GGA WC 0 4 Ex -0.050149217 0.056255553 0.106404771 2 1: GGA PBEJsJrLO 0 1 Ex -1.295100762 -1.388016047 0.092915285 2 1: GGA PBEJsJrLO 0 2 Ex -1.174688917 -1.081773629 0.092915288 2 1: GGA PBEJsJrLO 0 3 Ex -0.013805832 -0.074708205 0.060902373 2 1: GGA PBEJsJrLO 0 4 Ex -0.055082962 0.061738277 0.116821239 2 1: GGA PBEJsJrHEG 0 1 Ex -1.301598580 -1.384803383 0.083204804 2 1: GGA PBEJsJrHEG 0 2 Ex -1.185098097 -1.101893290 0.083204807 2 1: GGA PBEJsJrHEG 0 3 Ex -0.013357375 -0.067921325 0.054563950 2 1: GGA PBEJsJrHEG 0 4 Ex -0.053293691 0.051325302 0.104618993 2 1: GGA PBEGcGxLO 0 1 Ex -1.304935024 -1.384291930 0.079356906 2 1: GGA PBEGcGxLO 0 2 Ex -1.185211952 -1.105855043 0.079356909 2 1: GGA PBEGcGxLO 0 3 Ex -0.013726861 -0.065732047 0.052005186 2 1: GGA PBEGcGxLO 0 4 Ex -0.054767880 0.045004025 0.099771905 2 1: GGA PBEGcGxHEG 0 1 Ex -1.309508942 -1.381896001 0.072387059 2 1: GGA PBEGcGxHEG 0 2 Ex -1.192674519 -1.120287456 0.072387062 2 1: GGA PBEGcGxHEG 0 3 Ex -0.013395662 -0.060852067 0.047456404 2 1: GGA PBEGcGxHEG 0 4 Ex -0.053446454 0.037567282 0.091013736 2 1: GGA PBESOL 0 1 Ex -1.304935024 -1.384291930 0.079356906 2 1: GGA PBESOL 0 2 Ex -1.185211952 -1.105855043 0.079356909 2 1: GGA PBESOL 0 3 Ex -0.013726861 -0.065732047 0.052005186 2 1: GGA PBESOL 0 4 Ex -0.054767880 0.045004025 0.099771905 2 1: GGA AM05 0 1 Ex -1.334078590 -1.373567677 0.039489087 2 1: GGA AM05 0 1 Ec -0.082862320 -0.079322662 0.003539659 2 1: GGA AM05 0 2 Ex -1.210371432 -1.170882345 0.039489087 2 1: GGA AM05 0 2 Ec -0.092607468 -0.096147126 0.003539659 2 1: GGA AM05 0 3 Ex -0.014183657 -0.039968464 0.025784807 2 1: GGA AM05 0 3 Ec 0.001117331 0.003456462 0.002339131 2 1: GGA AM05 0 4 Ex -0.056590418 -0.006966041 0.049624377 2 1: GGA AM05 0 4 Ec 0.004457963 0.000002828 0.004455136 2 1: GGA PW86 0 1 Ex -1.223966475 -1.364923711 0.140957236 2 1: GGA PW86 0 2 Ex -1.120968034 -0.980010795 0.140957239 2 1: GGA PW86 0 3 Ex -0.011809297 -0.104406065 0.092596769 2 1: GGA PW86 0 4 Ex -0.047117119 0.130157974 0.177275093 2 1: GGA B88 0 1 Ex -1.281736673 -1.399946910 0.118210237 2 1: GGA B88 0 2 Ex -1.163830838 -1.045620598 0.118210240 2 1: GGA B88 0 3 Ex -0.013518505 -0.091062424 0.077543918 2 1: GGA B88 0 4 Ex -0.053936576 0.094703144 0.148639720 2 1: GGA C09 0 1 Ex -1.312905941 -1.382148518 0.069242577 2 1: GGA C09 0 2 Ex -1.191532120 -1.122289540 0.069242580 2 1: GGA C09 0 3 Ex -0.013916128 -0.059263125 0.045346997 2 1: GGA C09 0 4 Ex -0.055523022 0.031525085 0.087048107 2 1: GGA BH 0 1 Ex -1.309761082 -1.384035342 0.074274260 2 1: GGA BH 0 2 Ex -1.186564553 -1.112290290 0.074274263 2 1: GGA BH 0 3 Ex -0.014125110 -0.062758815 0.048633705 2 1: GGA BH 0 4 Ex -0.056356829 0.037014702 0.093371531 2 1: 1: iSpin dens gradDens 1: 1 0.296951637 -2.714165540 -0.549283373 -1.460651500 1: 2 0.260839825 0.752722750 2.132734314 -0.262687858 1: 3 0.023151709 -0.288257456 -2.095369114 0.269763646 1: 4 -0.077305335 0.012811106 -0.004145622 0.936752474 1: GGA PW91 0 1 Ex -0.764360847 -1.130722810 0.366361963 2 1: GGA PW91 0 2 Ex -0.741726999 -0.375365019 0.366361980 2 1: GGA PW91 0 3 Ex -0.014510827 -0.246788685 0.232277858 2 1: GGA PW91 0 4 Ex 0.048452766 -0.106680451 0.155133217 2 1: GGA PBE 0 1 Ex -0.768948007 -1.133529785 0.364581779 2 1: GGA PBE 0 2 Ex -0.754374811 -0.389793016 0.364581796 2 1: GGA PBE 0 3 Ex -0.009343048 -0.212126125 0.202783077 2 1: GGA PBE 0 4 Ex 0.031197154 -0.114687058 0.145884212 2 1: GGA RPBE 0 1 Ex -0.714251132 -1.201817457 0.487566325 2 1: GGA RPBE 0 2 Ex -0.699133176 -0.211566833 0.487566344 2 1: GGA RPBE 0 3 Ex -0.009692300 -0.316594346 0.306902047 2 1: GGA RPBE 0 4 Ex 0.032363333 -0.173427863 0.205791196 2 1: GGA revPBE 0 1 Ex -0.714033071 -1.184031266 0.469998195 2 1: GGA revPBE 0 2 Ex -0.691596375 -0.221598162 0.469998214 2 1: GGA revPBE 0 3 Ex -0.014384430 -0.330487433 0.316103002 2 1: GGA revPBE 0 4 Ex 0.048030718 -0.156412698 0.204443416 2 1: GGA LYP 0 1 Ex -0.730735965 -1.144189801 0.413453835 2 1: GGA LYP 0 1 Ec -0.075935188 -0.100738671 0.024803483 2 1: GGA LYP 0 2 Ex -0.696001216 -0.282547380 0.413453836 2 1: GGA LYP 0 2 Ec -0.088346506 -0.063543023 0.024803483 2 1: GGA LYP 0 3 Ex -0.022268858 -0.333018513 0.310749655 2 1: GGA LYP 0 3 Ec 0.007957043 0.088261844 0.080304801 2 1: GGA LYP 0 4 Ex 0.074357428 -0.115275916 0.189633344 2 1: GGA LYP 0 4 Ec -0.026569177 -0.008312428 0.018256749 2 1: GGA WC 0 1 Ex -0.761155658 -1.058627293 0.297471635 2 1: GGA WC 0 2 Ex -0.721661420 -0.424189769 0.297471651 2 1: GGA WC 0 3 Ex -0.025320223 -0.264820353 0.239500131 2 1: GGA WC 0 4 Ex 0.084546168 -0.056659560 0.141205727 2 1: GGA PBEJsJrLO 0 1 Ex -0.752880483 -1.066118756 0.313238273 2 1: GGA PBEJsJrLO 0 2 Ex -0.727457794 -0.414219504 0.313238290 2 1: GGA PBEJsJrLO 0 3 Ex -0.016298786 -0.221664138 0.205365351 2 1: GGA PBEJsJrLO 0 4 Ex 0.054422899 -0.080242562 0.134665461 2 1: GGA PBEJsJrHEG 0 1 Ex -0.785106635 -1.035767783 0.250661147 2 1: GGA PBEJsJrHEG 0 2 Ex -0.764048640 -0.513387477 0.250661163 2 1: GGA PBEJsJrHEG 0 3 Ex -0.013500530 -0.152641717 0.139141188 2 1: GGA PBEJsJrHEG 0 4 Ex 0.045079306 -0.055137184 0.100216490 2 1: GGA PBEGcGxLO 0 1 Ex -0.749931807 -1.032603351 0.282671544 2 1: GGA PBEGcGxLO 0 2 Ex -0.719660210 -0.436988650 0.282671560 2 1: GGA PBEGcGxLO 0 3 Ex -0.019407479 -0.219401610 0.199994132 2 1: GGA PBEGcGxLO 0 4 Ex 0.064803061 -0.061114454 0.125917515 2 1: GGA PBEGcGxHEG 0 1 Ex -0.777707312 -1.009837192 0.232129880 2 1: GGA PBEGcGxHEG 0 2 Ex -0.752391046 -0.520261151 0.232129896 2 1: GGA PBEGcGxHEG 0 3 Ex -0.016230557 -0.157820344 0.141589788 2 1: GGA PBEGcGxHEG 0 4 Ex 0.054195076 -0.042426455 0.096621531 2 1: GGA PBESOL 0 1 Ex -0.749931807 -1.032603351 0.282671544 2 1: GGA PBESOL 0 2 Ex -0.719660210 -0.436988650 0.282671560 2 1: GGA PBESOL 0 3 Ex -0.019407479 -0.219401610 0.199994132 2 1: GGA PBESOL 0 4 Ex 0.064803061 -0.061114454 0.125917515 2 1: GGA AM05 0 1 Ex -0.724512780 -0.927869133 0.203356352 2 1: GGA AM05 0 1 Ec -0.065999373 -0.059829578 0.006169795 2 1: GGA AM05 0 2 Ex -0.680004654 -0.476648301 0.203356353 2 1: GGA AM05 0 2 Ec -0.069949230 -0.076119025 0.006169795 2 1: GGA AM05 0 3 Ex -0.028534686 -0.222758266 0.194223581 2 1: GGA AM05 0 3 Ec 0.002532300 0.003773967 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0.024736084 0.033044555 0.008308471 2 1: GGA PBE 0 4 Ex -0.035780866 -0.040047566 0.004266700 2 1: GGA RPBE 0 1 Ex -0.277503121 -0.273359168 0.004143953 2 1: GGA RPBE 0 2 Ex -0.229433203 -0.233577183 0.004143980 2 1: GGA RPBE 0 3 Ex 0.039264443 0.040716905 0.001452462 2 1: GGA RPBE 0 4 Ex -0.056796208 -0.057545714 0.000749506 2 1: GGA revPBE 0 1 Ex -0.264869237 -0.216651488 0.048217749 2 1: GGA revPBE 0 2 Ex -0.244506971 -0.292724750 0.048217779 2 1: GGA revPBE 0 3 Ex 0.016632294 0.033573778 0.016941484 2 1: GGA revPBE 0 4 Ex -0.024058694 -0.032751407 0.008692713 2 1: GGA LYP 0 1 Ex -0.201930091 -0.008106654 0.193823437 2 1: GGA LYP 0 1 Ec 0.031415619 0.176342440 0.144926821 2 1: GGA LYP 0 2 Ex -0.223718148 -0.417541585 0.193823437 2 1: GGA LYP 0 2 Ec 0.116437960 -0.028488861 0.144926821 2 1: GGA LYP 0 3 Ex -0.017796908 0.130844841 0.148641749 2 1: GGA LYP 0 3 Ec 0.069447901 -0.075478345 0.144926246 2 1: GGA LYP 0 4 Ex 0.025743315 0.046480565 0.020737250 2 1: GGA LYP 0 4 Ec 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2 Ex -0.570825594 -0.479628309 0.091197285 2 1: GGA PBESOL 0 3 Ex 0.024093598 -0.139276830 0.163370428 2 1: GGA PBESOL 0 4 Ex -0.025168964 0.033676511 0.058845475 2 1: GGA AM05 0 1 Ex -0.442053997 -0.488465055 0.046411058 2 1: GGA AM05 0 1 Ec -0.064069927 -0.061507456 0.002562472 2 1: GGA AM05 0 2 Ex -0.546851216 -0.500440157 0.046411059 2 1: GGA AM05 0 2 Ec -0.052199801 -0.054762273 0.002562472 2 1: GGA AM05 0 3 Ex -0.021253161 -0.304873307 0.283620147 2 1: GGA AM05 0 3 Ec 0.002407294 0.005202253 0.002794959 2 1: GGA AM05 0 4 Ex 0.022201750 -0.139765193 0.161966943 2 1: GGA AM05 0 4 Ec -0.002514738 -0.005886915 0.003372177 2 1: GGA PW86 0 1 Ex -0.659836258 -0.771341728 0.111505470 2 1: GGA PW86 0 2 Ex -0.596800481 -0.485295005 0.111505475 2 1: GGA PW86 0 3 Ex 0.012783827 -0.251587305 0.264371132 2 1: GGA PW86 0 4 Ex -0.013354406 -0.003264696 0.010089710 2 1: GGA B88 0 1 Ex -0.509876263 -0.618597879 0.108721615 2 1: GGA B88 0 2 Ex -0.550115445 -0.441393826 0.108721619 2 1: GGA B88 0 3 Ex -0.008160615 -0.469152161 0.460991545 2 1: GGA B88 0 4 Ex 0.008524847 -0.176175298 0.184700145 2 1: GGA C09 0 1 Ex -0.696282230 -0.782168405 0.085886175 2 1: GGA C09 0 2 Ex -0.555432928 -0.469546749 0.085886179 2 1: GGA C09 0 3 Ex 0.028564621 -0.229434188 0.257998809 2 1: GGA C09 0 4 Ex -0.029839542 -0.074114178 0.044274637 2 1: GGA BH 0 1 Ex -0.674936167 -0.778486450 0.103550282 2 1: GGA BH 0 2 Ex -0.536910071 -0.433359784 0.103550286 2 1: GGA BH 0 3 Ex 0.027992067 -0.222194905 0.250186972 2 1: GGA BH 0 4 Ex -0.029241433 -0.024348731 0.004892703 2 1: 1: iSpin dens gradDens 1: 1 0.764852076 0.311476777 4.044384204 5.663161443 1: 2 1.027369881 6.227414574 -3.685513923 -4.509220123 1: 3 -0.494752285 7.485036181 -0.924011778 5.604051516 1: 4 0.633408537 0.554660029 7.664848560 2.628845278 1: GGA PW91 0 1 Ex -0.667468407 -0.711870373 0.044401966 2 1: GGA PW91 0 2 Ex -0.881225862 -0.836823889 0.044401973 2 1: GGA PW91 0 3 Ex 0.402856443 0.387178729 0.015677714 2 1: GGA PW91 0 4 Ex -0.515758528 -0.537205575 0.021447047 2 1: GGA PBE 0 1 Ex -1.164311108 -1.207015377 0.042704269 2 1: GGA PBE 0 2 Ex -1.240108614 -1.197404335 0.042704278 2 1: GGA PBE 0 3 Ex 0.142851221 0.129231223 0.013619998 2 1: GGA PBE 0 4 Ex -0.182885831 -0.202373798 0.019487967 2 1: GGA RPBE 0 1 Ex -1.165486189 -1.209922331 0.044436142 2 1: GGA RPBE 0 2 Ex -1.240156732 -1.195720581 0.044436151 2 1: GGA RPBE 0 3 Ex 0.140727300 0.126499586 0.014227713 2 1: GGA RPBE 0 4 Ex -0.180166673 -0.200488214 0.020321541 2 1: GGA revPBE 0 1 Ex -1.297973130 -1.342002468 0.044029337 2 1: GGA revPBE 0 2 Ex -1.336096302 -1.292066956 0.044029346 2 1: GGA revPBE 0 3 Ex 0.071848561 0.057878220 0.013970340 2 1: GGA revPBE 0 4 Ex -0.091984399 -0.112020607 0.020036208 2 1: GGA LYP 0 1 Ex -1.221420392 -1.324782352 0.103361960 2 1: GGA LYP 0 1 Ec -0.195495246 -0.196061477 0.000566230 2 1: GGA LYP 0 2 Ex -1.281764130 -1.178402170 0.103361960 2 1: GGA LYP 0 2 Ec -0.153248686 -0.152682456 0.000566230 2 1: GGA LYP 0 3 Ex 0.113726390 0.147672076 0.033945686 2 1: GGA LYP 0 3 Ec -0.079619674 -0.110041469 0.030421795 2 1: GGA LYP 0 4 Ex -0.145598653 -0.140503161 0.005095492 2 1: GGA LYP 0 4 Ec 0.101933397 0.078053746 0.023879652 2 1: GGA WC 0 1 Ex -1.165883160 -1.204086817 0.038203657 2 1: GGA WC 0 2 Ex -1.243248314 -1.205044647 0.038203666 2 1: GGA WC 0 3 Ex 0.145805678 0.133657696 0.012147983 2 1: GGA WC 0 4 Ex -0.186668286 -0.204073825 0.017405539 2 1: GGA PBEJsJrLO 0 1 Ex -1.168554418 -1.198789776 0.030235358 2 1: GGA PBEJsJrLO 0 2 Ex -1.246688354 -1.216452987 0.030235366 2 1: GGA PBEJsJrLO 0 3 Ex 0.147254557 0.137650649 0.009603908 2 1: GGA PBEJsJrLO 0 4 Ex -0.188523220 -0.202290353 0.013767134 2 1: GGA PBEJsJrHEG 0 1 Ex -1.092134586 -1.121564618 0.029430032 2 1: GGA PBEJsJrHEG 0 2 Ex -1.191830462 -1.162400422 0.029430041 2 1: GGA PBEJsJrHEG 0 3 Ex 0.187891112 0.178504485 0.009386627 2 1: GGA PBEJsJrHEG 0 4 Ex -0.240548327 -0.253978858 0.013430532 2 1: GGA PBEGcGxLO 0 1 Ex -1.170082379 -1.195035632 0.024953253 2 1: GGA PBEGcGxLO 0 2 Ex -1.249314474 -1.224361212 0.024953262 2 1: GGA PBEGcGxLO 0 3 Ex 0.149324196 0.141428711 0.007895485 2 1: GGA PBEGcGxLO 0 4 Ex -0.191172882 -0.202510984 0.011338102 2 1: GGA PBEGcGxHEG 0 1 Ex -1.093900862 -1.118288817 0.024387956 2 1: GGA PBEGcGxHEG 0 2 Ex -1.194517654 -1.170129690 0.024387965 2 1: GGA PBEGcGxHEG 0 3 Ex 0.189626711 0.181862624 0.007764087 2 1: GGA PBEGcGxHEG 0 4 Ex -0.242770334 -0.253888657 0.011118323 2 1: GGA PBESOL 0 1 Ex -1.170082379 -1.195035632 0.024953253 2 1: GGA PBESOL 0 2 Ex -1.249314474 -1.224361212 0.024953262 2 1: GGA PBESOL 0 3 Ex 0.149324196 0.141428711 0.007895485 2 1: GGA PBESOL 0 4 Ex -0.191172882 -0.202510984 0.011338102 2 1: GGA AM05 0 1 Ex -1.135771987 -1.175335075 0.039563087 2 1: GGA AM05 0 1 Ec -0.135517355 -0.133095964 0.002421391 2 1: GGA AM05 0 2 Ex -1.230954732 -1.191391644 0.039563087 2 1: GGA AM05 0 2 Ec -0.111695748 -0.114117138 0.002421391 2 1: GGA AM05 0 3 Ex 0.179385472 0.209380418 0.029994947 2 1: GGA AM05 0 3 Ec -0.044895219 -0.044120080 0.000775139 2 1: GGA AM05 0 4 Ex -0.229658948 -0.214428555 0.015230393 2 1: GGA AM05 0 4 Ec 0.057477279 0.058584512 0.001107233 2 1: GGA PW86 0 1 Ex -1.292248512 -1.358570813 0.066322301 2 1: GGA PW86 0 2 Ex -1.324614447 -1.258292135 0.066322312 2 1: GGA PW86 0 3 Ex 0.060998226 0.054933378 0.006064848 2 1: GGA PW86 0 4 Ex -0.078093216 -0.096574172 0.018480956 2 1: GGA B88 0 1 Ex -1.220512149 -1.323833775 0.103321626 2 1: GGA B88 0 2 Ex -1.280635311 -1.177313670 0.103321641 2 1: GGA B88 0 3 Ex 0.113310683 0.147262474 0.033951791 2 1: GGA B88 0 4 Ex -0.145066443 -0.139957833 0.005108610 2 5/9 Test #5: libgridxc_test6 .................. Passed 0.10 sec 1: GGA C09 0 1 Ex -1.314542176 -1.333707304 0.019165128 2 1: GGA C09 0 2 Ex -1.355258500 -1.336093362 0.019165138 2 1: GGA C09 0 3 Ex 0.076735725 0.070599377 0.006136348 2 1: GGA C09 0 4 Ex -0.098241210 -0.107005807 0.008764597 2 1: GGA BH 0 1 Ex -1.309838485 -1.342460493 0.032622008 2 1: GGA BH 0 2 Ex -1.351612770 -1.318990752 0.032622019 2 1: GGA BH 0 3 Ex 0.078729605 0.083139974 0.004410369 2 1: GGA BH 0 4 Ex -0.100793883 -0.104109111 0.003315228 2 1: 1: iSpin dens gradDens 1: 1 0.007037749 0.074414853 0.015267388 0.044998134 1: 2 0.009875374 0.008774516 -0.050347276 0.040480571 1: 3 0.000923974 -0.036032548 -0.059702575 0.012308716 1: 4 -0.003008195 0.024984051 -0.052276086 0.083356441 1: GGA PW91 0 1 Ex -0.152422240 -0.249734481 0.097312241 2 1: GGA PW91 0 2 Ex -0.214076181 -0.116763947 0.097312235 2 1: GGA PW91 0 3 Ex -0.020075459 0.085515986 0.105591445 2 1: GGA PW91 0 4 Ex 0.065359967 0.143689849 0.078329881 2 1: GGA PBE 0 1 Ex -0.343064731 -0.447602153 0.104537422 2 1: GGA PBE 0 2 Ex -0.292931973 -0.188394558 0.104537415 2 1: GGA PBE 0 3 Ex 0.016323987 0.130215643 0.113891656 2 1: GGA PBE 0 4 Ex -0.053146244 0.031140823 0.084287067 2 1: GGA RPBE 0 1 Ex -0.339278308 -0.480117345 0.140839037 2 1: GGA RPBE 0 2 Ex -0.278480715 -0.137641686 0.140839029 2 1: GGA RPBE 0 3 Ex 0.019796619 0.173218601 0.153421982 2 1: GGA RPBE 0 4 Ex -0.064452143 0.049098377 0.113550519 2 1: GGA revPBE 0 1 Ex -0.400160668 -0.533257703 0.133097035 2 1: GGA revPBE 0 2 Ex -0.306529107 -0.173432081 0.133097026 2 1: GGA revPBE 0 3 Ex 0.030487858 0.175510824 0.145022966 2 1: GGA revPBE 0 4 Ex -0.099259765 0.008059471 0.107319236 2 1: GGA LYP 0 1 Ex -0.319484205 -0.505223809 0.185739603 2 1: GGA LYP 0 1 Ec -1.272232680 -1.090496453 0.181736227 2 1: GGA LYP 0 2 Ex -0.280114892 -0.094375288 0.185739604 2 1: GGA LYP 0 2 Ec -0.634812198 -0.816548424 0.181736227 2 1: GGA LYP 0 3 Ex 0.012819246 0.220472521 0.207653275 2 1: GGA LYP 0 3 Ec 0.207553785 -0.006361167 0.213914952 2 1: GGA LYP 0 4 Ex -0.041735807 0.109649279 0.151385086 2 1: GGA LYP 0 4 Ec -0.675735899 -0.827156084 0.151420184 2 1: GGA WC 0 1 Ex -0.343790556 -0.423980960 0.080190404 2 1: GGA WC 0 2 Ex -0.297257770 -0.217067374 0.080190396 2 1: GGA WC 0 3 Ex 0.015151781 0.102527532 0.087375750 2 1: GGA WC 0 4 Ex -0.049329877 0.015329521 0.064659398 2 1: GGA PBEJsJrLO 0 1 Ex -0.341226544 -0.430140637 0.088914093 2 1: GGA PBEJsJrLO 0 2 Ex -0.290908164 -0.201994079 0.088914085 2 1: GGA PBEJsJrLO 0 3 Ex 0.016384428 0.113263348 0.096878920 2 1: GGA PBEJsJrLO 0 4 Ex -0.053343023 0.018349814 0.071692837 2 1: GGA PBEJsJrHEG 0 1 Ex -0.308634256 -0.380512094 0.071877838 2 1: GGA PBEJsJrHEG 0 2 Ex -0.283385482 -0.211507651 0.071877831 2 1: GGA PBEJsJrHEG 0 3 Ex 0.008221384 0.086530941 0.078309557 2 1: GGA PBEJsJrHEG 0 4 Ex -0.026766481 0.031187600 0.057954081 2 1: GGA PBEGcGxLO 0 1 Ex -0.340586358 -0.420208810 0.079622452 2 1: GGA PBEGcGxLO 0 2 Ex -0.291087767 -0.211465322 0.079622445 2 1: GGA PBEGcGxLO 0 3 Ex 0.016117493 0.102879247 0.086761754 2 1: GGA PBEGcGxLO 0 4 Ex -0.052473957 0.011728976 0.064202933 2 1: GGA PBEGcGxHEG 0 1 Ex -0.307839039 -0.374092541 0.066253502 2 1: GGA PBEGcGxHEG 0 2 Ex -0.282298353 -0.216044858 0.066253495 2 1: GGA PBEGcGxHEG 0 3 Ex 0.008316435 0.080501372 0.072184937 2 1: GGA PBEGcGxHEG 0 4 Ex -0.027075940 0.026344237 0.053420177 2 1: GGA PBESOL 0 1 Ex -0.340586358 -0.420208810 0.079622452 2 1: GGA PBESOL 0 2 Ex -0.291087767 -0.211465322 0.079622445 2 1: GGA PBESOL 0 3 Ex 0.016117493 0.102879247 0.086761754 2 1: GGA PBESOL 0 4 Ex -0.052473957 0.011728976 0.064202933 2 1: GGA AM05 0 1 Ex -0.276921947 -0.379621054 0.102699107 2 1: GGA AM05 0 1 Ec -0.045873652 -0.042934268 0.002939384 2 1: GGA AM05 0 2 Ex -0.262327764 -0.159628657 0.102699108 2 1: GGA AM05 0 2 Ec -0.039151152 -0.042090536 0.002939384 2 1: GGA AM05 0 3 Ex 0.004752087 0.120088606 0.115336519 2 1: GGA AM05 0 3 Ec 0.002188948 -0.001013132 0.003202080 2 1: GGA AM05 0 4 Ex -0.015471441 0.068392371 0.083863812 2 1: GGA AM05 0 4 Ec -0.007126589 -0.009496473 0.002369884 2 1: GGA PW86 0 1 Ex -0.367783189 -0.486785939 0.119002750 2 1: GGA PW86 0 2 Ex -0.311637451 -0.192634710 0.119002741 2 1: GGA PW86 0 3 Ex 0.018281905 0.149357750 0.131075846 2 1: GGA PW86 0 4 Ex -0.059520665 0.036867129 0.096387794 2 1: GGA B88 0 1 Ex -0.319470586 -0.505206792 0.185736206 2 1: GGA B88 0 2 Ex -0.280102244 -0.094366048 0.185736195 2 1: GGA B88 0 3 Ex 0.012818930 0.220468373 0.207649443 2 1: GGA B88 0 4 Ex -0.041734777 0.109647556 0.151382333 2 1: GGA C09 0 1 Ex -0.408688183 -0.491650811 0.082962628 2 1: GGA C09 0 2 Ex -0.314227955 -0.231265334 0.082962621 2 1: GGA C09 0 3 Ex 0.030757684 0.121132728 0.090375044 2 1: GGA C09 0 4 Ex -0.100138243 -0.033250086 0.066888157 2 1: GGA BH 0 1 Ex -0.358354338 -0.474434413 0.116080076 2 1: GGA BH 0 2 Ex -0.287744840 -0.171664773 0.116080067 2 1: GGA BH 0 3 Ex 0.022991524 0.150843177 0.127851653 2 1: GGA BH 0 4 Ex -0.074853842 0.019165156 0.094018999 2 1: 1: iSpin dens gradDens 1: 1 1.291544278 -10.680533765 7.551978929 4.230027083 1: 2 1.147340599 8.192700965 -7.195909497 -1.378661446 1: 3 0.065131692 -0.501246307 9.187784854 -0.126797178 1: 4 0.133924372 3.002281301 6.366244156 -7.349850762 1: GGA PW91 0 1 Ex -1.234565421 -1.505811673 0.271246251 2 1: GGA PW91 0 1 Ec -0.091417633 -0.091416497 0.000001136 2 1: GGA PW91 0 2 Ex -1.194560207 -0.923313953 0.271246254 2 1: GGA PW91 0 2 Ec -0.097009547 -0.097011711 0.000002164 2 1: GGA PW91 0 3 Ex -0.018068938 -0.651259857 0.633190919 2 1: GGA PW91 0 3 Ec 0.002525669 0.002527160 0.000001491 2 1: GGA PW91 0 4 Ex -0.037153512 0.416820218 0.453973731 2 1: GGA PW91 0 4 Ec 0.005193304 0.005196369 0.000003065 2 1: GGA PBE 0 1 Ex -1.226967096 -1.508537841 0.281570745 2 1: GGA PBE 0 2 Ex -1.202605243 -0.921034496 0.281570747 2 1: GGA PBE 0 3 Ex -0.011003386 -0.646993633 0.635990247 2 1: GGA PBE 0 4 Ex -0.022625262 0.438268346 0.460893608 2 1: GGA RPBE 0 1 Ex -1.140546303 -1.497151326 0.356605023 2 1: GGA RPBE 0 2 Ex -1.095316958 -0.738711933 0.356605025 2 1: GGA RPBE 0 3 Ex -0.020428493 -0.871126434 0.850697941 2 1: GGA RPBE 0 4 Ex -0.042005251 0.563704304 0.605709554 2 1: GGA revPBE 0 1 Ex -1.156594941 -1.493967009 0.337372069 2 1: GGA revPBE 0 2 Ex -1.107916539 -0.770544467 0.337372072 2 1: GGA revPBE 0 3 Ex -0.021986309 -0.830132510 0.808146201 2 1: GGA revPBE 0 4 Ex -0.045208447 0.529452256 0.574660703 2 1: GGA LYP 0 1 Ex -1.208632383 -1.494982545 0.286350161 2 1: GGA LYP 0 1 Ec -0.066577771 -0.073829635 0.007251865 2 1: GGA LYP 0 2 Ex -1.150124917 -0.863774756 0.286350162 2 1: GGA LYP 0 2 Ec -0.068179314 -0.060927449 0.007251865 2 1: GGA LYP 0 3 Ex -0.026425749 -0.722975471 0.696549721 2 1: GGA LYP 0 3 Ec 0.000723360 0.024562825 0.023839465 2 1: GGA LYP 0 4 Ex -0.054336864 0.438581899 0.492918763 2 1: GGA LYP 0 4 Ec 0.001487380 -0.006202272 0.007689653 2 1: GGA WC 0 1 Ex -1.260224605 -1.460640901 0.200416296 2 1: GGA WC 0 2 Ex -1.191326937 -0.990910638 0.200416299 2 1: GGA WC 0 3 Ex -0.031118636 -0.535069939 0.503951304 2 1: GGA WC 0 4 Ex -0.063986418 0.289000731 0.352987149 2 1: GGA PBEJsJrLO 0 1 Ex -1.223124788 -1.450377021 0.227252233 2 1: GGA PBEJsJrLO 0 2 Ex -1.176216935 -0.948964699 0.227252236 2 1: GGA PBEJsJrLO 0 3 Ex -0.021186615 -0.561046760 0.539860145 2 1: GGA PBEJsJrLO 0 4 Ex -0.043564109 0.341334511 0.384898620 2 1: GGA PBEJsJrHEG 0 1 Ex -1.264925100 -1.458649600 0.193724500 2 1: GGA PBEJsJrHEG 0 2 Ex -1.232013959 -1.038289456 0.193724503 2 1: GGA PBEJsJrHEG 0 3 Ex -0.014864796 -0.452180327 0.437315531 2 1: GGA PBEJsJrHEG 0 4 Ex -0.030565128 0.286412208 0.316977336 2 1: GGA PBEGcGxLO 0 1 Ex -1.228084636 -1.426580036 0.198495401 2 1: GGA PBEGcGxLO 0 2 Ex -1.172591838 -0.974096435 0.198495403 2 1: GGA PBEGcGxLO 0 3 Ex -0.025064130 -0.508646104 0.483581974 2 1: GGA PBEGcGxLO 0 4 Ex -0.051537090 0.290509636 0.342046727 2 1: GGA PBEGcGxHEG 0 1 Ex -1.261699996 -1.435007254 0.173307258 2 1: GGA PBEGcGxHEG 0 2 Ex -1.219548986 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0.006746592 2 1: GGA PBEGcGxLO 0 1 Ex -0.192532226 -0.187524242 0.005007984 2 1: GGA PBEGcGxLO 0 2 Ex -0.242098123 -0.247106102 0.005007979 2 1: GGA PBEGcGxLO 0 3 Ex -0.001108601 0.026818639 0.027927240 2 1: GGA PBEGcGxLO 0 4 Ex -0.005722326 0.010556450 0.016278777 2 1: GGA PBEGcGxHEG 0 1 Ex -0.168411057 -0.165916825 0.002494232 2 1: GGA PBEGcGxHEG 0 2 Ex -0.220084467 -0.222578695 0.002494228 2 1: GGA PBEGcGxHEG 0 3 Ex -0.001155738 0.012840065 0.013995804 2 1: GGA PBEGcGxHEG 0 4 Ex -0.005965636 0.002125249 0.008090885 2 1: GGA PBESOL 0 1 Ex -0.192532226 -0.187524242 0.005007984 2 1: GGA PBESOL 0 2 Ex -0.242098123 -0.247106102 0.005007979 2 1: GGA PBESOL 0 3 Ex -0.001108601 0.026818639 0.027927240 2 1: GGA PBESOL 0 4 Ex -0.005722326 0.010556450 0.016278777 2 1: GGA AM05 0 1 Ex -0.129800979 -0.057214295 0.072586684 2 1: GGA AM05 0 1 Ec -0.038160493 -0.038179806 0.000019314 2 1: GGA AM05 0 2 Ex -0.143799587 -0.216386271 0.072586684 2 1: GGA AM05 0 2 Ec -0.022228951 -0.022209637 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0 3 Ex 0.142168076 0.392144114 0.249976038 2 1: GGA RPBE 0 4 Ex 0.021308846 0.603857588 0.582548742 2 1: GGA revPBE 0 1 Ex -0.805536993 -0.054440299 0.751096694 2 1: GGA revPBE 0 2 Ex -0.681509036 -1.432605741 0.751096705 2 1: GGA revPBE 0 3 Ex 0.103453981 0.450351365 0.346897384 2 1: GGA revPBE 0 4 Ex 0.015506188 0.704946207 0.689440019 2 1: GGA LYP 0 1 Ex -0.557346939 0.458730452 1.016077391 2 1: GGA LYP 0 1 Ec -0.228817610 -0.318419724 0.089602114 2 1: GGA LYP 0 2 Ex -0.566098142 -1.582175533 1.016077391 2 1: GGA LYP 0 2 Ec -0.122608595 -0.033006482 0.089602114 2 1: GGA LYP 0 3 Ex -0.007299538 0.481064842 0.488364379 2 1: GGA LYP 0 3 Ec 0.088590876 0.030671996 0.057918880 2 1: GGA LYP 0 4 Ex -0.001094090 0.804246497 0.805340587 2 1: GGA LYP 0 4 Ec 0.013278433 0.041354653 0.028076220 2 1: GGA WC 0 1 Ex -0.757948162 -0.218942107 0.539006056 2 1: GGA WC 0 2 Ex -0.652603737 -1.191609802 0.539006066 2 1: GGA WC 0 3 Ex 0.087869706 0.334339134 0.246469428 2 1: GGA WC 0 4 Ex 0.013170341 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-0.866840276 0.020196408 2 1: GGA LYP 0 2 Ec -0.430644920 -0.462761684 0.032116763 2 1: GGA LYP 0 3 Ex -0.020736406 -0.175305220 0.154568814 2 1: GGA LYP 0 3 Ec 0.143191233 0.216611200 0.073419966 2 1: GGA LYP 0 4 Ex -0.034880540 0.063107974 0.097988513 2 1: GGA LYP 0 4 Ec 0.240860812 0.206909474 0.033951339 2 1: GGA WC 0 1 Ex -0.977459250 -0.955427493 0.022031758 2 1: GGA WC 0 2 Ex -0.952671130 -0.974702879 0.022031749 2 1: GGA WC 0 3 Ex 0.024404668 -0.018315417 0.042720085 2 1: GGA WC 0 4 Ex 0.041050894 0.073099721 0.032048826 2 1: GGA PBEJsJrLO 0 1 Ex -0.963136733 -0.938495397 0.024641336 2 1: GGA PBEJsJrLO 0 2 Ex -0.931158311 -0.955799639 0.024641328 2 1: GGA PBEJsJrLO 0 3 Ex 0.031483741 -0.016356234 0.047839975 2 1: GGA PBEJsJrLO 0 4 Ex 0.052958546 0.088839018 0.035880472 2 1: GGA PBEJsJrHEG 0 1 Ex -0.890574739 -0.869013158 0.021561580 2 1: GGA PBEJsJrHEG 0 2 Ex -0.894960250 -0.916521821 0.021561572 2 1: GGA PBEJsJrHEG 0 3 Ex -0.004317671 -0.045511997 0.041194327 2 1: GGA PBEJsJrHEG 0 4 Ex -0.007262719 0.023737091 0.030999810 2 1: GGA PBEGcGxLO 0 1 Ex -0.961204656 -0.939962148 0.021242508 2 1: GGA PBEGcGxLO 0 2 Ex -0.933337022 -0.954579521 0.021242500 2 1: GGA PBEGcGxLO 0 3 Ex 0.027436545 -0.014392431 0.041828975 2 1: GGA PBEGcGxLO 0 4 Ex 0.046150789 0.077431562 0.031280773 2 1: GGA PBEGcGxHEG 0 1 Ex -0.889533554 -0.870522319 0.019011235 2 1: GGA PBEGcGxHEG 0 2 Ex -0.895852335 -0.914863561 0.019011226 2 1: GGA PBEGcGxHEG 0 3 Ex -0.006221035 -0.042812489 0.036591454 2 1: GGA PBEGcGxHEG 0 4 Ex -0.010464352 0.017029061 0.027493413 2 1: GGA PBESOL 0 1 Ex -0.961204656 -0.939962148 0.021242508 2 1: GGA PBESOL 0 2 Ex -0.933337022 -0.954579521 0.021242500 2 1: GGA PBESOL 0 3 Ex 0.027436545 -0.014392431 0.041828975 2 1: GGA PBESOL 0 4 Ex 0.046150789 0.077431562 0.031280773 2 1: GGA AM05 0 1 Ex -0.747043907 -0.742689865 0.004354043 2 1: GGA AM05 0 1 Ec -0.081569222 -0.082258617 0.000689395 2 1: GGA AM05 0 2 Ex -0.809321849 -0.813675891 0.004354042 2 1: GGA AM05 0 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-0.924644181 0.017986758 2 1: GGA BH 0 2 Ex -0.917049177 -0.935035929 0.017986752 2 1: GGA BH 0 3 Ex 0.025186034 -0.044434726 0.069620760 2 1: GGA BH 0 4 Ex 0.042365223 0.089185179 0.046819956 2 1: 1: iSpin dens gradDens 1: 1 0.192069388 -0.514742816 -0.411513387 0.632467768 1: 2 0.224369444 1.493790096 0.015325904 -1.891682869 1: 3 -0.064366750 -0.948198059 1.733669529 1.987489779 1: 4 0.126071801 0.462184383 0.037738186 -1.707416985 1: GGA PW91 0 1 Ex -0.931880442 -0.874659220 0.057221221 2 1: GGA PW91 0 2 Ex -0.912848416 -0.970069634 0.057221218 2 1: GGA PW91 0 3 Ex -0.037926548 0.023515833 0.061442381 2 1: GGA PW91 0 4 Ex 0.074284753 0.112984697 0.038699943 2 1: GGA PBE 0 1 Ex -0.863626507 -0.758909779 0.104716728 2 1: GGA PBE 0 2 Ex -0.864370736 -0.969087462 0.104716725 2 1: GGA PBE 0 3 Ex 0.001483081 0.121332803 0.119849721 2 1: GGA PBE 0 4 Ex -0.002904834 0.071699606 0.074604440 2 1: GGA RPBE 0 1 Ex -0.853571158 -0.703168615 0.150402543 2 1: GGA RPBE 0 2 Ex -0.840868314 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0.125899380 2 1: GGA WC 0 4 Ex 0.029417473 0.107786842 0.078369369 2 1: GGA PBEJsJrLO 0 1 Ex -0.831757961 -0.730262365 0.101495596 2 1: GGA PBEJsJrLO 0 2 Ex -0.828837613 -0.930333207 0.101495594 2 1: GGA PBEJsJrLO 0 3 Ex -0.005819596 0.110420876 0.116240473 2 1: GGA PBEJsJrLO 0 4 Ex 0.011398540 0.083747623 0.072349082 2 1: GGA PBEJsJrHEG 0 1 Ex -0.802097567 -0.730203153 0.071894414 2 1: GGA PBEJsJrHEG 0 2 Ex -0.815933887 -0.887828298 0.071894411 2 1: GGA PBEJsJrHEG 0 3 Ex 0.027572675 0.109856345 0.082283670 2 1: GGA PBEJsJrHEG 0 4 Ex -0.054005162 -0.002784904 0.051220257 2 1: GGA PBEGcGxLO 0 1 Ex -0.817613751 -0.720340096 0.097273654 2 1: GGA PBEGcGxLO 0 2 Ex -0.814188540 -0.911462192 0.097273652 2 1: GGA PBEGcGxLO 0 3 Ex -0.006825674 0.104639280 0.111464954 2 1: GGA PBEGcGxLO 0 4 Ex 0.013369092 0.082739165 0.069370073 2 1: GGA PBEGcGxHEG 0 1 Ex -0.789382365 -0.718130574 0.071251791 2 1: GGA PBEGcGxHEG 0 2 Ex -0.801525664 -0.872777453 0.071251789 2 1: GGA PBEGcGxHEG 0 3 Ex 0.024198864 0.105773201 0.081574336 2 1: GGA PBEGcGxHEG 0 4 Ex -0.047397055 0.003378726 0.050775781 2 1: GGA PBESOL 0 1 Ex -0.817613751 -0.720340096 0.097273654 2 1: GGA PBESOL 0 2 Ex -0.814188540 -0.911462192 0.097273652 2 1: GGA PBESOL 0 3 Ex -0.006825674 0.104639280 0.111464954 2 1: GGA PBESOL 0 4 Ex 0.013369092 0.082739165 0.069370073 2 1: GGA AM05 0 1 Ex -0.605792434 -0.455973696 0.149818738 2 1: GGA AM05 0 1 Ec -0.074316682 -0.074980641 0.000663959 2 1: GGA AM05 0 2 Ex -0.631700322 -0.781519059 0.149818738 2 1: GGA AM05 0 2 Ec -0.067734998 -0.067071039 0.000663959 2 1: GGA AM05 0 3 Ex 0.051628596 0.227688268 0.176059673 2 1: GGA AM05 0 3 Ec -0.013115817 -0.013875218 0.000759401 2 1: GGA AM05 0 4 Ex -0.101122241 0.007958185 0.109080427 2 1: GGA AM05 0 4 Ec 0.025689268 0.025216497 0.000472771 2 1: GGA PW86 0 1 Ex -0.827704236 -0.695677388 0.132026848 2 1: GGA PW86 0 2 Ex -0.843855897 -0.975882743 0.132026846 2 1: GGA PW86 0 3 Ex 0.032186629 0.185617486 0.153430856 2 1: GGA PW86 0 4 Ex 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-1.270675472 -1.206372957 0.064302515 2 1: GGA PW91 0 1 Ec -0.132625784 -0.132629922 0.000004139 2 1: GGA PW91 0 2 Ex -1.260732667 -1.325035184 0.064302516 2 1: GGA PW91 0 2 Ec -0.133753156 -0.133757365 0.000004209 2 1: GGA PW91 0 3 Ex 0.505927932 0.482621691 0.023306241 2 1: GGA PW91 0 3 Ec -0.057365006 -0.057368580 0.000003574 2 1: GGA PW91 0 4 Ex -0.396317952 -0.426876643 0.030558690 2 1: GGA PW91 0 4 Ec 0.044936799 0.044939598 0.000002799 2 1: GGA PBE 0 1 Ex -1.561382500 -1.482035080 0.079347420 2 1: GGA PBE 0 2 Ex -1.555955003 -1.635302425 0.079347422 2 1: GGA PBE 0 3 Ex 0.276171817 0.266588449 0.009583368 2 1: GGA PBE 0 4 Ex -0.216338814 -0.229568007 0.013229193 2 1: GGA RPBE 0 1 Ex -1.571111203 -1.489869739 0.081241464 2 1: GGA RPBE 0 2 Ex -1.565874783 -1.647116248 0.081241465 2 1: GGA RPBE 0 3 Ex 0.266449096 0.256089058 0.010360039 2 1: GGA RPBE 0 4 Ex -0.208722535 -0.222966963 0.014244428 2 1: GGA revPBE 0 1 Ex -1.694603776 -1.612351829 0.082251947 2 1: GGA revPBE 0 2 Ex -1.691281303 -1.773533251 0.082251948 2 1: GGA revPBE 0 3 Ex 0.169060126 0.159835486 0.009224640 2 1: GGA revPBE 0 4 Ex -0.132433018 -0.145240704 0.012807686 2 1: GGA LYP 0 1 Ex -1.456428199 -1.250602578 0.205825621 2 1: GGA LYP 0 1 Ec -0.139434753 -0.114709769 0.024724985 2 1: GGA LYP 0 2 Ex -1.449325151 -1.655150772 0.205825621 2 1: GGA LYP 0 2 Ec -0.141588841 -0.166313825 0.024724985 2 1: GGA LYP 0 3 Ex 0.361430242 0.420298212 0.058867970 2 1: GGA LYP 0 3 Ec -0.109608214 -0.124514999 0.014906785 2 1: GGA LYP 0 4 Ex -0.283125885 -0.210558624 0.072567261 2 1: GGA LYP 0 4 Ec 0.085861444 0.066521728 0.019339716 2 1: GGA WC 0 1 Ex -1.560643867 -1.487994085 0.072649782 2 1: GGA WC 0 2 Ex -1.555103159 -1.627752942 0.072649783 2 1: GGA WC 0 3 Ex 0.281932390 0.273367813 0.008564577 2 1: GGA WC 0 4 Ex -0.220851352 -0.232695972 0.011844620 2 1: GGA PBEJsJrLO 0 1 Ex -1.563677762 -1.507282920 0.056394843 2 1: GGA PBEJsJrLO 0 2 Ex -1.558066644 -1.614461488 0.056394844 2 1: GGA PBEJsJrLO 0 3 Ex 0.285515169 0.279090423 0.006424746 2 1: GGA PBEJsJrLO 0 4 Ex -0.223657916 -0.232566988 0.008909072 2 1: GGA PBEJsJrHEG 0 1 Ex -1.487258177 -1.432575318 0.054682859 2 1: GGA PBEJsJrHEG 0 2 Ex -1.480438514 -1.535121374 0.054682860 2 1: GGA PBEJsJrHEG 0 3 Ex 0.347010554 0.340403252 0.006607302 2 1: GGA PBEJsJrHEG 0 4 Ex -0.271830242 -0.280950884 0.009120642 2 1: GGA PBEGcGxLO 0 1 Ex -1.563288376 -1.516464847 0.046823529 2 1: GGA PBEGcGxLO 0 2 Ex -1.557577244 -1.604400774 0.046823530 2 1: GGA PBEGcGxLO 0 3 Ex 0.290604273 0.285564954 0.005039319 2 1: GGA PBEGcGxLO 0 4 Ex -0.227644459 -0.234664873 0.007020415 2 1: GGA PBEGcGxHEG 0 1 Ex -1.488463997 -1.443100181 0.045363816 2 1: GGA PBEGcGxHEG 0 2 Ex -1.481574703 -1.526938520 0.045363817 2 1: GGA PBEGcGxHEG 0 3 Ex 0.350553599 0.345214576 0.005339024 2 1: GGA PBEGcGxHEG 0 4 Ex -0.274605682 -0.281990380 0.007384699 2 1: GGA PBESOL 0 1 Ex -1.563288376 -1.516464847 0.046823529 2 1: GGA PBESOL 0 2 Ex -1.557577244 -1.604400774 0.046823530 2 1: GGA PBESOL 0 3 Ex 0.290604273 0.285564954 0.005039319 2 1: GGA PBESOL 0 4 Ex -0.227644459 -0.234664873 0.007020415 2 1: GGA AM05 0 1 Ex -1.392736680 -1.309486447 0.083250233 2 1: GGA AM05 0 1 Ec -0.139034961 -0.143068694 0.004033733 2 1: GGA AM05 0 2 Ex -1.383923742 -1.467173975 0.083250233 2 1: GGA AM05 0 2 Ec -0.140370177 -0.136336444 0.004033733 2 1: GGA AM05 0 3 Ex 0.448436040 0.493979189 0.045543149 2 1: GGA AM05 0 3 Ec -0.067940905 -0.067427827 0.000513078 2 1: GGA AM05 0 4 Ex -0.351281757 -0.294186990 0.057094767 2 1: GGA AM05 0 4 Ec 0.053221415 0.053926994 0.000705579 2 1: GGA PW86 0 1 Ex -1.541164740 -1.414077265 0.127087476 2 1: GGA PW86 0 2 Ex -1.535813682 -1.662901159 0.127087477 2 1: GGA PW86 0 3 Ex 0.272282346 0.281786476 0.009504130 2 1: GGA PW86 0 4 Ex -0.213292002 -0.202753503 0.010538500 2 1: GGA B88 0 1 Ex -1.454230910 -1.248539025 0.205691886 2 1: GGA B88 0 2 Ex -1.447155007 -1.652846895 0.205691888 2 1: GGA B88 0 3 Ex 0.360049046 0.418920169 0.058871123 2 1: GGA B88 0 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-0.109958334 0.122972463 2 1: GGA LYP 0 4 Ex -0.010987867 -0.026385697 0.015397830 2 1: GGA LYP 0 4 Ec 0.232595809 0.237048466 0.004452657 2 1: GGA WC 0 1 Ex -0.561091428 -0.551373767 0.009717661 2 1: GGA WC 0 2 Ex -0.565143066 -0.574860736 0.009717670 2 1: GGA WC 0 3 Ex 0.003534399 0.092779345 0.089244946 2 1: GGA WC 0 4 Ex 0.063168754 0.057863711 0.005305043 2 1: GGA PBEJsJrLO 0 1 Ex -0.571421259 -0.563087942 0.008333318 2 1: GGA PBEJsJrLO 0 2 Ex -0.574532557 -0.582865883 0.008333327 2 1: GGA PBEJsJrLO 0 3 Ex 0.002714103 0.083306631 0.080592528 2 1: GGA PBEJsJrLO 0 4 Ex 0.048507973 0.043731443 0.004776529 2 1: GGA PBEJsJrHEG 0 1 Ex -0.553178455 -0.547087252 0.006091203 2 1: GGA PBEJsJrHEG 0 2 Ex -0.552824510 -0.558915722 0.006091212 2 1: GGA PBEJsJrHEG 0 3 Ex -0.000308760 0.055289797 0.055598557 2 1: GGA PBEJsJrHEG 0 4 Ex -0.005518330 -0.008824500 0.003306170 2 1: GGA PBEGcGxLO 0 1 Ex -0.561313320 -0.553585818 0.007727503 2 1: GGA PBEGcGxLO 0 2 Ex -0.564618918 -0.572346430 0.007727512 2 1: GGA PBEGcGxLO 0 3 Ex 0.002883599 0.081318783 0.078435184 2 1: GGA PBEGcGxLO 0 4 Ex 0.051537297 0.046900903 0.004636394 2 1: GGA PBEGcGxHEG 0 1 Ex -0.543739564 -0.537782236 0.005957329 2 1: GGA PBEGcGxHEG 0 2 Ex -0.543757506 -0.549714844 0.005957337 2 1: GGA PBEGcGxHEG 0 3 Ex 0.000015652 0.055895296 0.055879645 2 1: GGA PBEGcGxHEG 0 4 Ex 0.000279735 -0.003037869 0.003317604 2 1: GGA PBESOL 0 1 Ex -0.561313320 -0.553585818 0.007727503 2 1: GGA PBESOL 0 2 Ex -0.564618918 -0.572346430 0.007727512 2 1: GGA PBESOL 0 3 Ex 0.002883599 0.081318783 0.078435184 2 1: GGA PBESOL 0 4 Ex 0.051537297 0.046900903 0.004636394 2 1: GGA AM05 0 1 Ex -0.422685231 -0.445743637 0.023058406 2 1: GGA AM05 0 1 Ec -0.055842547 -0.055920354 0.000077807 2 1: GGA AM05 0 2 Ex -0.420224442 -0.397166035 0.023058406 2 1: GGA AM05 0 2 Ec -0.056980296 -0.056902489 0.000077807 2 1: GGA AM05 0 3 Ex -0.002146640 0.186924655 0.189071295 2 1: GGA AM05 0 3 Ec 0.000992502 0.000324366 0.000668136 2 1: GGA AM05 0 4 Ex -0.038365959 -0.048205336 0.009839376 2 1: GGA AM05 0 4 Ec 0.017738547 0.017778425 0.000039879 2 1: GGA PW86 0 1 Ex -0.577837992 -0.584459886 0.006621893 2 1: GGA PW86 0 2 Ex -0.577638896 -0.571017012 0.006621884 2 1: GGA PW86 0 3 Ex -0.000173680 0.136526986 0.136700666 2 1: GGA PW86 0 4 Ex -0.003104099 -0.010540360 0.007436261 2 1: GGA B88 0 1 Ex -0.475413529 -0.508474978 0.033061449 2 1: GGA B88 0 2 Ex -0.474710141 -0.441648701 0.033061440 2 1: GGA B88 0 3 Ex -0.000613592 0.293515301 0.294128893 2 1: GGA B88 0 4 Ex -0.010966466 -0.026363187 0.015396722 2 1: GGA C09 0 1 Ex -0.576788378 -0.567133554 0.009654824 2 1: GGA C09 0 2 Ex -0.586650773 -0.596305607 0.009654833 2 1: GGA C09 0 3 Ex 0.008603342 0.126056254 0.117452911 2 1: GGA C09 0 4 Ex 0.153763764 0.146882453 0.006881311 2 1: GGA BH 0 1 Ex -0.478033466 -0.476802518 0.001230948 2 1: GGA BH 0 2 Ex -0.484692591 -0.485923548 0.001230957 2 1: GGA BH 0 3 Ex 0.005809007 0.198044616 0.192235609 2 1: GGA BH 0 4 Ex 0.103821839 0.093026463 0.010795376 2 1: 1: iSpin dens gradDens 1: 1 0.141101804 -0.704324655 -0.697754748 -1.828734018 1: 2 0.281278484 -0.188044456 -1.773525548 -2.038409895 1: 3 -0.027660812 0.951708977 1.479485973 -0.125782549 1: 4 0.033508171 0.983860416 -0.763431919 1.079875999 1: GGA PW91 0 1 Ex -1.282748097 -1.286847007 0.004098910 2 1: GGA PW91 0 2 Ex -0.837131210 -0.833032335 0.004098876 2 1: GGA PW91 0 3 Ex -0.087932779 0.095652965 0.183585744 2 1: GGA PW91 0 4 Ex 0.106521333 0.249496841 0.142975508 2 1: GGA PBE 0 1 Ex -0.934200352 -0.980242892 0.046042540 2 1: GGA PBE 0 2 Ex -0.836207464 -0.790164959 0.046042506 2 1: GGA PBE 0 3 Ex -0.019336760 0.115116369 0.134453129 2 1: GGA PBE 0 4 Ex 0.023424456 0.038108644 0.014684188 2 1: GGA RPBE 0 1 Ex -1.090962441 -1.142209097 0.051246655 2 1: GGA RPBE 0 2 Ex -0.787226895 -0.735980277 0.051246619 2 1: GGA RPBE 0 3 Ex -0.059935589 0.150199743 0.210135332 2 1: GGA RPBE 0 4 Ex 0.072605676 0.138879777 0.066274101 2 1: GGA revPBE 0 1 Ex 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0.032393201 12.859156962 12.826763761 2 1: GGA PBEJsJrLO 0 4 Ex 0.012076654 2.746776159 2.734699506 2 1: GGA PBEJsJrHEG 0 1 Ex -0.821405932 3.825149933 4.646555865 2 1: GGA PBEJsJrHEG 0 2 Ex -0.723917798 -5.370473666 4.646555868 2 1: GGA PBEJsJrHEG 0 3 Ex 0.026155650 8.125936313 8.099780664 2 1: GGA PBEJsJrHEG 0 4 Ex 0.009751204 1.510797282 1.501046078 2 1: GGA PBEGcGxLO 0 1 Ex -0.764211204 6.855777735 7.619988939 2 1: GGA PBEGcGxLO 0 2 Ex -0.659620263 -8.279609205 7.619988942 2 1: GGA PBEGcGxLO 0 3 Ex 0.028061302 13.111697257 13.083635955 2 1: GGA PBEGcGxLO 0 4 Ex 0.010461659 3.006835550 2.996373892 2 1: GGA PBEGcGxHEG 0 1 Ex -0.792467951 4.130967201 4.923435152 2 1: GGA PBEGcGxHEG 0 2 Ex -0.701067214 -5.624502369 4.923435155 2 1: GGA PBEGcGxHEG 0 3 Ex 0.024522427 8.562889623 8.538367196 2 1: GGA PBEGcGxHEG 0 4 Ex 0.009142315 1.717824962 1.708682647 2 1: GGA PBESOL 0 1 Ex -0.764211204 6.855777735 7.619988939 2 1: GGA PBESOL 0 2 Ex -0.659620263 -8.279609205 7.619988942 2 1: GGA PBESOL 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4 Ex -0.009201567 -0.043667324 0.034465756 2 1: GGA C09 0 1 Ex -0.106899743 -0.107006868 0.000107125 2 1: GGA C09 0 2 Ex -0.140083453 -0.139976290 0.000107163 2 1: GGA C09 0 3 Ex -0.006059280 -0.007085951 0.001026672 2 1: GGA C09 0 4 Ex 0.012484255 0.012128381 0.000355874 2 1: GGA BH 0 1 Ex -0.128887475 -0.136704010 0.007816535 2 1: GGA BH 0 2 Ex -0.116463935 -0.108647342 0.007816593 2 1: GGA BH 0 3 Ex 0.002268514 -0.034912092 0.037180605 2 1: GGA BH 0 4 Ex -0.004673939 -0.012331257 0.007657318 2 1: 1: iSpin dens gradDens 1: 1 0.090131550 9.136765653 12.894600537 -5.377247550 1: 2 2.689404788 -10.318649825 -4.406919078 -9.843428604 1: 3 0.352455441 -5.161650824 7.233140006 -0.289378751 1: 4 -0.181541545 12.425197346 9.004719472 12.801056282 1: GGA PW91 0 1 Ex -0.037394385 -0.058461980 0.021067596 2 1: GGA PW91 0 2 Ex -1.609128747 -1.588060978 0.021067768 2 1: GGA PW91 0 3 Ex -0.213123545 -0.205655313 0.007468232 2 1: GGA PW91 0 4 Ex 0.109774948 0.275096066 0.165321118 2 1: GGA PBE 0 1 Ex -0.723317379 -0.744321482 0.021004103 2 1: GGA PBE 0 2 Ex -1.615412897 -1.594408618 0.021004279 2 1: GGA PBE 0 3 Ex -0.120966089 -0.113517596 0.007448493 2 1: GGA PBE 0 4 Ex 0.062306800 0.227135078 0.164828278 2 1: GGA RPBE 0 1 Ex -0.723071807 -0.745957136 0.022885329 2 1: GGA RPBE 0 2 Ex -1.601374111 -1.578488608 0.022885503 2 1: GGA RPBE 0 3 Ex -0.119095761 -0.110980273 0.008115489 2 1: GGA RPBE 0 4 Ex 0.061343438 0.240934144 0.179590706 2 1: GGA revPBE 0 1 Ex -0.891137520 -0.913482597 0.022345077 2 1: GGA revPBE 0 2 Ex -1.609132434 -1.586787186 0.022345248 2 1: GGA revPBE 0 3 Ex -0.097358450 -0.089434279 0.007924172 2 1: GGA revPBE 0 4 Ex 0.050147058 0.225498707 0.175351648 2 1: GGA LYP 0 1 Ex -2.162622856 -2.184724779 0.022101922 2 1: GGA LYP 0 1 Ec -0.389580178 -0.404057081 0.014476904 2 1: GGA LYP 0 2 Ex -1.657115678 -1.635013756 0.022101922 2 1: GGA LYP 0 2 Ec -0.047515105 -0.033038203 0.014476902 2 1: GGA LYP 0 3 Ex 0.068545604 0.108322707 0.039777102 2 1: GGA LYP 0 3 Ec 0.046383233 0.035262582 0.011120651 2 1: GGA LYP 0 4 Ex -0.035306236 0.200144684 0.235450920 2 1: GGA LYP 0 4 Ec -0.023890917 0.058157400 0.082048317 2 1: GGA WC 0 1 Ex -0.723913319 -0.740849521 0.016936202 2 1: GGA WC 0 2 Ex -1.644516188 -1.627579814 0.016936374 2 1: GGA WC 0 3 Ex -0.124831620 -0.118825570 0.006006050 2 1: GGA WC 0 4 Ex 0.064297845 0.197203987 0.132906142 2 1: GGA PBEJsJrLO 0 1 Ex -0.723825769 -0.739111813 0.015286044 2 1: GGA PBEJsJrLO 0 2 Ex -1.639621005 -1.624334793 0.015286212 2 1: GGA PBEJsJrLO 0 3 Ex -0.124179716 -0.118758868 0.005420848 2 1: GGA PBEJsJrLO 0 4 Ex 0.063962064 0.183918722 0.119956657 2 1: GGA PBEJsJrHEG 0 1 Ex -0.627934601 -0.642404453 0.014469852 2 1: GGA PBEJsJrHEG 0 2 Ex -1.643577952 -1.629107930 0.014470021 2 1: GGA PBEJsJrHEG 0 3 Ex -0.137718890 -0.132587558 0.005131332 2 1: GGA PBEJsJrHEG 0 4 Ex 0.070935775 0.184487327 0.113551551 2 1: GGA PBEGcGxLO 0 1 Ex -0.724055830 -0.736810728 0.012754898 2 1: GGA PBEGcGxLO 0 2 Ex -1.650946390 -1.638191325 0.012755065 2 1: GGA PBEGcGxLO 0 3 Ex -0.125684217 -0.121160908 0.004523308 2 1: GGA PBEGcGxLO 0 4 Ex 0.064736997 0.164830908 0.100093911 2 1: GGA PBEGcGxHEG 0 1 Ex -0.628135121 -0.640324122 0.012189002 2 1: GGA PBEGcGxHEG 0 2 Ex -1.653056284 -1.640867113 0.012189171 2 1: GGA PBEGcGxHEG 0 3 Ex -0.138976940 -0.134654409 0.004322531 2 1: GGA PBEGcGxHEG 0 4 Ex 0.071583768 0.167236708 0.095652941 2 1: GGA PBESOL 0 1 Ex -0.724055830 -0.736810728 0.012754898 2 1: GGA PBESOL 0 2 Ex -1.650946390 -1.638191325 0.012755065 2 1: GGA PBESOL 0 3 Ex -0.125684217 -0.121160908 0.004523308 2 1: GGA PBESOL 0 4 Ex 0.064736997 0.164830908 0.100093911 2 1: GGA AM05 0 1 Ex -1.848779528 -1.852756403 0.003976876 2 1: GGA AM05 0 1 Ec -0.250456780 -0.249914400 0.000542380 2 1: GGA AM05 0 2 Ex -1.713274449 -1.709297577 0.003976872 2 1: GGA AM05 0 2 Ec -0.052575235 -0.053117616 0.000542381 2 1: GGA AM05 0 3 Ex 0.018374175 0.038203525 0.019829349 2 1: GGA AM05 0 3 Ec 0.026832280 0.026639945 0.000192335 2 1: GGA AM05 0 4 Ex -0.009464107 0.057503762 0.066967870 2 1: GGA AM05 0 4 Ec -0.013820679 -0.018076940 0.004256261 2 1: GGA PW86 0 1 Ex -1.827109881 -1.856287572 0.029177691 2 1: GGA PW86 0 2 Ex -1.573474625 -1.544296754 0.029177871 2 1: GGA PW86 0 3 Ex 0.034392354 0.047703229 0.013310875 2 1: GGA PW86 0 4 Ex -0.017714696 0.217009034 0.234723731 2 1: GGA B88 0 1 Ex -2.162052420 -2.184131891 0.022079471 2 1: GGA B88 0 2 Ex -1.654435758 -1.632356088 0.022079670 2 1: GGA B88 0 3 Ex 0.068831646 0.108599162 0.039767516 2 1: GGA B88 0 4 Ex -0.035453569 0.199819373 0.235272942 2 1: GGA C09 0 1 Ex -0.892533561 -0.902783641 0.010250080 2 1: GGA C09 0 2 Ex -1.664712651 -1.654462402 0.010250249 2 1: GGA C09 0 3 Ex -0.104705699 -0.101070826 0.003634874 2 1: GGA C09 0 4 Ex 0.053931454 0.134368794 0.080437340 2 1: GGA BH 0 1 Ex -1.805615143 -1.816430904 0.010815761 2 1: GGA BH 0 2 Ex -1.681996081 -1.671180144 0.010815937 2 1: GGA BH 0 3 Ex 0.016762459 0.023521261 0.006758802 2 1: GGA BH 0 4 Ex -0.008633950 0.081918075 0.090552025 2 1: 1: Some errors found. Error codes: 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 0.15 sec 2: 2: funcs= VDW 2: auths= BH 2: dr, rMax = 0.200000 20.000000 2: iSpin r dens Vxc dExc/dDens diff 2: 1 0.000 0.047620227 -0.999477920 2: 1 0.200 0.047382720 -0.999360161 -1.000195377 0.000835216 2: 1 0.400 0.046677283 -0.999006885 -0.998709430 -0.000297455 3: Ex, Ec = -3.716289981 -0.771674483 3: Dx, Dc = 1.192543612 0.121155159 2: 1 0.600 0.045524817 -0.987412253 -0.987507969 0.000095716 2: 1 0.800 0.043959010 -0.980158453 -0.980143390 -0.000015063 2: 1 1.000 0.042024703 -0.963929151 -0.963927468 -0.000001684 2: 1 1.200 0.039775757 -0.949006509 -0.949005824 -0.000000686 2: 1 1.400 0.037272568 -0.929353368 -0.929356346 0.000002978 3: i1 i2 i3 iSpin Vxc dExc/dDens diff 3: 2 8 13 2 -0.313847006 -0.313846990 -0.000000016 2: 1 1.600 0.034579382 -0.908100586 -0.908099055 -0.000001531 2: 1 1.800 0.031761587 -0.884442948 -0.884442165 -0.000000783 2: 1 2.000 0.028883127 -0.858808538 -0.858809369 0.000000831 2: 1 2.200 0.026004187 -0.831341143 -0.831341120 -0.000000022 2: 1 2.400 0.023179251 -0.802320622 -0.802320402 -0.000000220 2: 1 2.600 0.020455616 -0.772056571 -0.772056927 0.000000356 3: 4 2 23 2 -0.524218962 -0.524218950 -0.000000011 2: 1 2.800 0.017872394 -0.740675199 -0.740674876 -0.000000323 2: 1 3.000 0.015460016 -0.708430779 -0.708429554 -0.000001225 2: 1 3.200 0.013240188 -0.675669578 -0.675674010 0.000004432 2: 1 3.400 0.011226266 -0.642459702 -0.642454691 -0.000005011 2: 1 3.600 0.009423960 -0.609091304 -0.609092448 0.000001145 3: 5 6 2 1 -0.626312320 -0.626312325 0.000000005 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 -0.510077515 -0.000000814 2: 1 4.400 0.004234421 -0.478003232 -0.478007538 0.000004306 2: 1 4.600 0.003381238 -0.446577649 -0.446566568 -0.000011081 2: 1 4.800 0.002673091 -0.416186718 -0.416202730 0.000016012 3: 4 2 9 2 -0.561691010 -0.561691005 -0.000000005 2: 1 5.000 0.002092223 -0.386734472 -0.386724843 -0.000009630 2: 1 5.200 0.001621280 -0.359258071 -0.359253814 -0.000004258 2: 1 5.400 0.001243837 -0.329009264 -0.329019033 0.000009768 2: 1 5.600 0.000944766 -0.268263860 -0.268258609 -0.000005251 2: 1 5.800 0.000710460 -0.184072378 -0.184073423 0.000001045 3: 7 3 21 1 -0.491741169 -0.491741176 0.000000007 2: 1 6.000 0.000528944 -0.147193854 -0.147194457 0.000000604 2: 1 6.200 0.000389881 -0.169127143 -0.169125287 -0.000001857 2: 1 6.400 0.000284517 -0.195915387 -0.195917508 0.000002121 2: 1 6.600 0.000205559 -0.203472102 -0.203471425 -0.000000677 2: 1 6.800 0.000147033 -0.198598658 -0.198597592 -0.000001066 2: 1 7.000 0.000104122 -0.189565923 -0.189567430 0.000001507 3: 1 2 0 2 -0.680189858 -0.680189866 0.000000008 2: 1 7.200 0.000072999 -0.181016372 -0.181015280 -0.000001093 2: 1 7.400 0.000050669 -0.173604245 -0.173604994 0.000000749 2: 1 7.600 0.000034818 -0.165710223 -0.165709117 -0.000001106 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 -0.000003884 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 2: 1 9.000 0.000001902 -0.074352560 -0.074354361 0.000001801 2: 1 9.200 0.000001206 -0.066227937 -0.066230345 0.000002408 2: 1 9.400 0.000000757 -0.059254673 -0.059259092 0.000004419 2: 1 9.600 0.000000470 -0.053256096 -0.053258876 0.000002779 2: 1 9.800 0.000000289 -0.047889328 -0.047892332 0.000003004 2: 1 10.000 0.000000176 -0.043050812 -0.043053582 0.000002770 2: 1 10.200 0.000000106 -0.038722914 -0.038725316 0.000002403 2: 1 10.400 0.000000063 -0.034770816 -0.034772942 0.000002126 2: 1 10.600 0.000000037 -0.031177334 -0.031179203 0.000001869 2: 1 10.800 0.000000022 -0.027908137 -0.027909788 0.000001650 2: 1 11.000 0.000000013 -0.024937534 -0.024938993 0.000001459 2: 1 11.200 0.000000007 -0.022242269 -0.022243481 0.000001212 2: 1 11.400 0.000000004 -0.019801203 -0.019802317 0.000001114 2: 1 11.600 0.000000002 -0.017594752 -0.017595964 0.000001212 2: 1 11.800 0.000000001 -0.015604553 -0.015605291 0.000000738 2: iSpin r dens Vxc dExc/dDens diff 2: 2 0.000 0.031746818 -0.915508806 2: 2 0.200 0.031588480 -0.915751674 -0.916586171 0.000834496 2: 2 0.400 0.031118189 -0.916480278 -0.916182799 -0.000297479 2: 2 0.600 0.030349878 -0.905234497 -0.905330299 0.000095802 2: 2 0.800 0.029306007 -0.899618247 -0.899603224 -0.000015023 2: 2 1.000 0.028016469 -0.884545454 -0.884543785 -0.000001670 2: 2 1.200 0.026517171 -0.871612702 -0.871612023 -0.000000680 2: 2 1.400 0.024848378 -0.853952605 -0.853955594 0.000002989 2: 2 1.600 0.023052921 -0.835057592 -0.835056080 -0.000001511 2: 2 1.800 0.021174391 -0.813963082 -0.813962307 -0.000000775 2: 2 2.000 0.019255418 -0.791103995 -0.791104826 0.000000831 2: 2 2.200 0.017336125 -0.766590785 -0.766590759 -0.000000026 2: 2 2.400 0.015452834 -0.740674175 -0.740673946 -0.000000229 2: 2 2.600 0.013637077 -0.713633471 -0.713633828 0.000000357 2: 2 2.800 0.011914930 -0.685564496 -0.685564174 -0.000000322 2: 2 3.000 0.010306678 -0.656691901 -0.656690678 -0.000001223 2: 2 3.200 0.008826792 -0.627334141 -0.627338574 0.000004433 2: 2 3.400 0.007484177 -0.597534542 -0.597529533 -0.000005010 2: 2 3.600 0.006282640 -0.567562765 -0.567563906 0.000001141 2: 2 3.800 0.005221523 -0.537678412 -0.537680206 0.000001794 2: 2 4.000 0.004296443 -0.507860006 -0.507858935 -0.000001071 2: 2 4.200 0.003500077 -0.478500307 -0.478499494 -0.000000814 2: 2 4.400 0.002822947 -0.449602251 -0.449606559 0.000004308 2: 2 4.600 0.002254159 -0.421308745 -0.421297662 -0.000011083 2: 2 4.800 0.001782061 -0.394081537 -0.394097550 0.000016012 2: 2 5.000 0.001394815 -0.368503162 -0.368493534 -0.000009628 2: 2 5.200 0.001080853 -0.338654863 -0.338650608 -0.000004255 2: 2 5.400 0.000829225 -0.277895720 -0.277905487 0.000009767 2: 2 5.600 0.000629844 -0.196381546 -0.196376297 -0.000005249 2: 2 5.800 0.000473640 -0.161618667 -0.161619715 0.000001048 2: 2 6.000 0.000352629 -0.182070066 -0.182070670 0.000000604 2: 2 6.200 0.000259921 -0.206718897 -0.206717039 -0.000001859 2: 2 6.400 0.000189678 -0.212964826 -0.212966944 0.000002118 2: 2 6.600 0.000137039 -0.206427971 -0.206427295 -0.000000676 2: 2 6.800 0.000098022 -0.195576084 -0.195575020 -0.000001064 2: 2 7.000 0.000069415 -0.184792808 -0.184794315 0.000001507 2: 2 7.200 0.000048666 -0.176119925 -0.176118834 -0.000001092 2: 2 7.400 0.000033779 -0.169045503 -0.169046254 0.000000751 2: 2 7.600 0.000023212 -0.161554180 -0.161553078 -0.000001102 2: 2 7.800 0.000015792 -0.151793526 -0.151794848 0.000001322 2: 2 8.000 0.000010636 -0.138751509 -0.138752581 0.000001072 2: 2 8.200 0.000007092 -0.123406831 -0.123402998 -0.000003833 2: 2 8.400 0.000004681 -0.107833248 -0.107835424 0.000002176 2: 2 8.600 0.000003059 -0.093844217 -0.093845341 0.000001124 2: 2 8.800 0.000001979 -0.082118108 -0.082117784 -0.000000324 2: 2 9.000 0.000001268 -0.072533230 -0.072536399 0.000003169 2: 2 9.200 0.000000804 -0.064613896 -0.064617440 0.000003544 2: 2 9.400 0.000000504 -0.057796389 -0.057800206 0.000003816 2: 2 9.600 0.000000313 -0.051913010 -0.051915902 0.000002893 2: 2 9.800 0.000000193 -0.046631823 -0.046634643 0.000002820 2: 2 10.000 0.000000117 -0.041859516 -0.041862069 0.000002553 2: 2 10.200 0.000000071 -0.037586671 -0.037588902 0.000002231 2: 2 10.400 0.000000042 -0.033684342 -0.033686321 0.000001979 2: 2 10.600 0.000000025 -0.030139120 -0.030140865 0.000001745 2: 2 10.800 0.000000015 -0.026918806 -0.026920321 0.000001515 2: 2 11.000 0.000000008 -0.023998661 -0.023999989 0.000001328 2: 2 11.200 0.000000005 -0.021355613 -0.021356851 0.000001238 2: 2 11.400 0.000000003 -0.018968230 -0.018969169 0.000000939 2: 2 11.600 0.000000002 -0.016816386 -0.016817189 0.000000804 2: avgDiffVxc, maxDiffVxc = 0.000088758 0.000835216 7/9 Test #2: libgridxc_test2 .................. Passed 5.50 sec 4: 4: funcs= VDW 4: auths= BH 4: dr, dx, Ecut = 0.024000 0.408248 59.217626 4: rMax, rBuff = 12.000000 3.000000 4: atomEx, cellEx, diff = -4.299743248 -4.299745396 0.000002148 4: atomEc, cellEc, diff = -0.679499275 -0.679753307 0.000254032 4: atomDx, cellDx, diff = 1.349799036 1.349797201 0.000001835 4: atomDc, cellDc, diff = 0.155982425 0.155866069 0.000116356 4: avgDiffVxc, maxDiffVxc = 0.000006163 0.038047291 8/9 Test #4: libgridxc_test4 .................. Passed 5.93 sec 3: xc stress * volume = 3: -4.405894836 -0.011039400 0.003122993 3: -0.011039400 -4.442866097 0.004079677 3: 0.003122993 0.004079677 -4.466819185 3: dExc/dStrain = 3: -4.405917144 -0.011032696 0.003063851 3: -0.011032696 -4.442868111 0.004097451 3: 0.003063851 0.004097451 -4.466975974 3: diff = 3: 0.000022309 -0.000006705 0.000059142 3: -0.000006705 0.000002015 -0.000017774 3: 0.000059142 -0.000017774 0.000156789 9/9 Test #3: libgridxc_test3 .................. Passed 7.33 sec 100% tests passed, 0 tests failed out of 9 Total Test time (real) = 7.34 sec make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' create-stamp debian/debhelper-build-stamp dh_testroot -O--buildsystem=cmake dh_prep -O--buildsystem=cmake dh_auto_install --destdir=debian/libgridxc-dev/ -O--buildsystem=cmake cd obj-aarch64-linux-gnu && make -j12 install DESTDIR=/build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev AM_UPDATE_INFO_DIR=no "INSTALL=install --strip-program=true" make[1]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' /usr/bin/cmake -S/build/reproducible-path/libgridxc-2.1.0 -B/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu --check-build-system CMakeFiles/Makefile.cmake 0 /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/CMakeFiles /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu//CMakeFiles/progress.marks make -f CMakeFiles/Makefile2 all make[2]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f CMakeFiles/libgridxc-lib.dir/build.make CMakeFiles/libgridxc-lib.dir/depend make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/CMakeFiles/libgridxc-lib.dir/DependInfo.cmake "--color=" make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f CMakeFiles/libgridxc-lib.dir/build.make CMakeFiles/libgridxc-lib.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Nothing to be done for 'CMakeFiles/libgridxc-lib.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' [ 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[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test1.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-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test2.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-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test3.dir/DependInfo.cmake "--color=" 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[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test4.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test6.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_libxc2.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/depend cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_match.dir/DependInfo.cmake "--color=" make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' cd /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu && /usr/bin/cmake -E cmake_depends "Unix Makefiles" /build/reproducible-path/libgridxc-2.1.0 /build/reproducible-path/libgridxc-2.1.0/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/Testers/CMakeFiles/libgridxc-test_hse06.dir/DependInfo.cmake "--color=" make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-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-2.1.0/obj-aarch64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test3.dir/build.make Testers/CMakeFiles/libgridxc-test3.dir/build make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test1.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_libxc.dir/build.make Testers/CMakeFiles/libgridxc-test_libxc.dir/build make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test3.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-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-2.1.0/obj-aarch64-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]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test4.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test2.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test6.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-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-2.1.0/obj-aarch64-linux-gnu' 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-2.1.0/obj-aarch64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_match.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_libxc2.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make -f Testers/CMakeFiles/libgridxc-test_hse06.dir/build.make Testers/CMakeFiles/libgridxc-test_hse06.dir/build [ 68%] Built target libgridxc-test3 make[3]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' [ 76%] Built target libgridxc-test_match make[3]: Nothing to be done for 'Testers/CMakeFiles/libgridxc-test_hse06.dir/build'. make[3]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' [ 72%] Built target libgridxc-test1 [ 80%] Built target libgridxc-test_libxc [ 84%] Built target libgridxc-test4 [ 92%] Built target libgridxc-test2 [ 92%] Built target libgridxc-test6 [100%] Built target libgridxc-test_libxc2 [100%] Built target libgridxc-test_hse06 make[2]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' /usr/bin/cmake -E cmake_progress_start /build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu/CMakeFiles 0 make -f CMakeFiles/Makefile2 preinstall make[2]: Entering directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' make[2]: Nothing to be done for 'preinstall'. make[2]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' Install the project... /usr/bin/cmake -P cmake_install.cmake -- Install configuration: "RelWithDebInfo" -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/aarch64-linux-gnu/cmake/libgridxc/libgridxc-config.cmake -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/aarch64-linux-gnu/cmake/libgridxc/libgridxc-config-version.cmake -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/aarch64-linux-gnu/pkgconfig/libgridxc.pc -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/aarch64-linux-gnu/libgridxc.a -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/aarch64-linux-gnu/cmake/libgridxc/libgridxc-targets.cmake -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/lib/aarch64-linux-gnu/cmake/libgridxc/libgridxc-targets-relwithdebinfo.cmake -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0 -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cell.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_atom.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_xcmod.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_vdwxc.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fftr.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_vv_vdwxc.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fft3d.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_radfft.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gga.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_debugxc.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh3d.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_hybrids.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_moreparallelsubs.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_mesh1d.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_chkgmx.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_minvec.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_fft_gpfa.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gpfa_core_dp.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_gpfa_core_sp.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_xwpbe.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_io.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_interpolation.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_lda.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_bessph.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_array.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_am05.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_cellsubs.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_sorting.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_alloc.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_config.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_sys.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_walltime.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/include/libgridxc/GNU-14.2.0/gridxc_precision.mod -- Installing: /build/reproducible-path/libgridxc-2.1.0/debian/libgridxc-dev/usr/share/licenses/libgridxc/COPYING make[1]: Leaving directory '/build/reproducible-path/libgridxc-2.1.0/obj-aarch64-linux-gnu' dh_installdocs -O--buildsystem=cmake dh_installchangelogs -O--buildsystem=cmake dh_installinit -O--buildsystem=cmake dh_installsystemduser -O--buildsystem=cmake dh_perl -O--buildsystem=cmake dh_link -O--buildsystem=cmake dh_strip_nondeterminism -O--buildsystem=cmake dh_compress -O--buildsystem=cmake dh_fixperms -O--buildsystem=cmake dh_missing -O--buildsystem=cmake dh_dwz -O--buildsystem=cmake dh_strip -O--buildsystem=cmake dh_makeshlibs -O--buildsystem=cmake dh_shlibdeps -O--buildsystem=cmake dh_installdeb -O--buildsystem=cmake dh_gencontrol -O--buildsystem=cmake dpkg-gencontrol: warning: Depends field of package libgridxc-dev: substitution variable ${shlibs:Depends} used, but is not defined dh_md5sums -O--buildsystem=cmake dh_builddeb -O--buildsystem=cmake dpkg-deb: building package 'libgridxc-dev' in '../libgridxc-dev_2.1.0-1_arm64.deb'. dpkg-genbuildinfo --build=binary -O../libgridxc_2.1.0-1_arm64.buildinfo dpkg-genchanges --build=binary -O../libgridxc_2.1.0-1_arm64.changes dpkg-genchanges: info: binary-only upload (no source code included) dpkg-source --after-build . dpkg-buildpackage: info: binary-only upload (no source included) dpkg-genchanges: info: including full source code in upload I: copying local configuration 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/3718922 and its subdirectories I: Current time: Sun Mar 9 17:17:49 -12 2025 I: pbuilder-time-stamp: 1741583869