I: pbuilder: network access will be disabled during build I: Current time: Sat Jan 22 15:15:57 +14 2022 I: pbuilder-time-stamp: 1642814157 I: Building the build Environment I: extracting base tarball [/var/cache/pbuilder/buster-reproducible-base.tgz] I: copying local configuration 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 [elkcode_5.4.24-2.dsc] I: copying [./elkcode_5.4.24.orig.tar.gz] I: copying [./elkcode_5.4.24-2.debian.tar.xz] I: Extracting source gpgv: unknown type of key resource 'trustedkeys.kbx' gpgv: keyblock resource '/root/.gnupg/trustedkeys.kbx': General error gpgv: Signature made Fri Jan 11 04:19:44 2019 +14 gpgv: using RSA key 9CA877749FAB2E4FA96862ECDC686A27B43481B0 gpgv: Can't check signature: No public key dpkg-source: warning: failed to verify signature on ./elkcode_5.4.24-2.dsc dpkg-source: info: extracting elkcode in elkcode-5.4.24 dpkg-source: info: unpacking elkcode_5.4.24.orig.tar.gz dpkg-source: info: unpacking elkcode_5.4.24-2.debian.tar.xz dpkg-source: info: using patch list from debian/patches/series dpkg-source: info: applying default_data_directory.patch dpkg-source: info: applying makeflags.patch dpkg-source: info: applying testsuite_quick.patch dpkg-source: info: applying makefile_clean.patch I: using fakeroot in build. I: Installing the build-deps I: user script /srv/workspace/pbuilder/33056/tmp/hooks/D01_modify_environment starting debug: Running on ionos15-amd64. I: Changing host+domainname to test build reproducibility I: Adding a custom variable just for the fun of it... I: Changing /bin/sh to bash Removing 'diversion of /bin/sh to /bin/sh.distrib by dash' Adding 'diversion of /bin/sh to /bin/sh.distrib by bash' Removing 'diversion of /usr/share/man/man1/sh.1.gz to /usr/share/man/man1/sh.distrib.1.gz by dash' Adding 'diversion of /usr/share/man/man1/sh.1.gz to /usr/share/man/man1/sh.distrib.1.gz by bash' I: Setting pbuilder2's login shell to /bin/bash I: Setting pbuilder2's GECOS to second user,second room,second work-phone,second home-phone,second other I: user script /srv/workspace/pbuilder/33056/tmp/hooks/D01_modify_environment finished I: user script /srv/workspace/pbuilder/33056/tmp/hooks/D02_print_environment starting I: set BASH=/bin/sh BASHOPTS=checkwinsize:cmdhist:complete_fullquote:extquote:force_fignore:globasciiranges:hostcomplete:interactive_comments:progcomp:promptvars:sourcepath BASH_ALIASES=() BASH_ARGC=() BASH_ARGV=() BASH_CMDS=() BASH_LINENO=([0]="12" [1]="0") BASH_SOURCE=([0]="/tmp/hooks/D02_print_environment" [1]="/tmp/hooks/D02_print_environment") BASH_VERSINFO=([0]="5" [1]="0" [2]="3" [3]="1" [4]="release" [5]="x86_64-pc-linux-gnu") BASH_VERSION='5.0.3(1)-release' BUILDDIR=/build BUILDUSERGECOS='second user,second room,second work-phone,second home-phone,second other' BUILDUSERNAME=pbuilder2 BUILD_ARCH=amd64 DEBIAN_FRONTEND=noninteractive DEB_BUILD_OPTIONS='buildinfo=+all reproducible=+all parallel=16' DIRSTACK=() DISTRIBUTION= EUID=0 FUNCNAME=([0]="Echo" [1]="main") GROUPS=() HOME=/root HOSTNAME=i-capture-the-hostname HOSTTYPE=x86_64 HOST_ARCH=amd64 IFS=' ' INVOCATION_ID=a23243a534dc432b8b8777eff1f09c51 LANG=C LANGUAGE=et_EE:et LC_ALL=C MACHTYPE=x86_64-pc-linux-gnu MAIL=/var/mail/root OPTERR=1 OPTIND=1 OSTYPE=linux-gnu PATH=/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path PBCURRENTCOMMANDLINEOPERATION=build PBUILDER_OPERATION=build PBUILDER_PKGDATADIR=/usr/share/pbuilder PBUILDER_PKGLIBDIR=/usr/lib/pbuilder PBUILDER_SYSCONFDIR=/etc PIPESTATUS=([0]="0") POSIXLY_CORRECT=y PPID=33056 PS4='+ ' PWD=/ SHELL=/bin/bash SHELLOPTS=braceexpand:errexit:hashall:interactive-comments:posix SHLVL=3 SUDO_COMMAND='/usr/bin/timeout -k 24.1h 24h /usr/bin/ionice -c 3 /usr/bin/nice -n 11 /usr/bin/unshare --uts -- /usr/sbin/pbuilder --build --configfile /srv/reproducible-results/rbuild-debian/tmp.mtyJriBwVf/pbuilderrc_ImKq --hookdir /etc/pbuilder/rebuild-hooks --debbuildopts -b --basetgz /var/cache/pbuilder/buster-reproducible-base.tgz --buildresult /srv/reproducible-results/rbuild-debian/tmp.mtyJriBwVf/b2 --logfile b2/build.log elkcode_5.4.24-2.dsc' SUDO_GID=111 SUDO_UID=106 SUDO_USER=jenkins TERM=unknown TZ=/usr/share/zoneinfo/Etc/GMT-14 UID=0 USER=root _='I: set' http_proxy=http://85.184.249.68:3128 I: uname -a Linux i-capture-the-hostname 5.9.0-0.bpo.2-amd64 #1 SMP Debian 5.9.6-1~bpo10+1 (2020-11-19) x86_64 GNU/Linux I: ls -l /bin total 5116 -rwxr-xr-x 1 root root 1168776 Apr 18 2019 bash -rwxr-xr-x 3 root root 38984 Jul 11 2019 bunzip2 -rwxr-xr-x 3 root root 38984 Jul 11 2019 bzcat lrwxrwxrwx 1 root root 6 Jul 11 2019 bzcmp -> bzdiff -rwxr-xr-x 1 root root 2227 Jul 11 2019 bzdiff lrwxrwxrwx 1 root root 6 Jul 11 2019 bzegrep -> bzgrep -rwxr-xr-x 1 root root 4877 Jun 25 2019 bzexe lrwxrwxrwx 1 root root 6 Jul 11 2019 bzfgrep -> bzgrep -rwxr-xr-x 1 root root 3641 Jul 11 2019 bzgrep -rwxr-xr-x 3 root root 38984 Jul 11 2019 bzip2 -rwxr-xr-x 1 root root 14328 Jul 11 2019 bzip2recover lrwxrwxrwx 1 root root 6 Jul 11 2019 bzless -> bzmore -rwxr-xr-x 1 root root 1297 Jul 11 2019 bzmore -rwxr-xr-x 1 root root 43744 Mar 1 2019 cat -rwxr-xr-x 1 root root 64320 Mar 1 2019 chgrp -rwxr-xr-x 1 root root 64288 Mar 1 2019 chmod -rwxr-xr-x 1 root root 72512 Mar 1 2019 chown -rwxr-xr-x 1 root root 146880 Mar 1 2019 cp -rwxr-xr-x 1 root root 121464 Jan 18 2019 dash -rwxr-xr-x 1 root root 109408 Mar 1 2019 date -rwxr-xr-x 1 root root 76712 Mar 1 2019 dd -rwxr-xr-x 1 root root 93744 Mar 1 2019 df -rwxr-xr-x 1 root root 138856 Mar 1 2019 dir -rwxr-xr-x 1 root root 84288 Jan 10 2019 dmesg lrwxrwxrwx 1 root root 8 Sep 27 2018 dnsdomainname -> hostname lrwxrwxrwx 1 root root 8 Sep 27 2018 domainname -> hostname -rwxr-xr-x 1 root root 39520 Mar 1 2019 echo -rwxr-xr-x 1 root root 28 Jan 8 2019 egrep -rwxr-xr-x 1 root root 35424 Mar 1 2019 false -rwxr-xr-x 1 root root 28 Jan 8 2019 fgrep -rwxr-xr-x 1 root root 68880 Jan 10 2019 findmnt -rwsr-xr-x 1 root root 34896 Apr 23 2020 fusermount -rwxr-xr-x 1 root root 198976 Jan 8 2019 grep -rwxr-xr-x 2 root root 2345 Jan 6 2019 gunzip -rwxr-xr-x 1 root root 6375 Jan 6 2019 gzexe -rwxr-xr-x 1 root root 98048 Jan 6 2019 gzip -rwxr-xr-x 1 root root 26696 Sep 27 2018 hostname -rwxr-xr-x 1 root root 68552 Mar 1 2019 ln -rwxr-xr-x 1 root root 56760 Jul 27 2018 login -rwxr-xr-x 1 root root 138856 Mar 1 2019 ls -rwxr-xr-x 1 root root 108624 Jan 10 2019 lsblk -rwxr-xr-x 1 root root 89088 Mar 1 2019 mkdir -rwxr-xr-x 1 root root 68544 Mar 1 2019 mknod -rwxr-xr-x 1 root root 43808 Mar 1 2019 mktemp -rwxr-xr-x 1 root root 43008 Jan 10 2019 more -rwsr-xr-x 1 root root 51280 Jan 10 2019 mount -rwxr-xr-x 1 root root 14408 Jan 10 2019 mountpoint -rwxr-xr-x 1 root root 138728 Mar 1 2019 mv lrwxrwxrwx 1 root root 8 Sep 27 2018 nisdomainname -> hostname lrwxrwxrwx 1 root root 14 Feb 15 2019 pidof -> /sbin/killall5 -rwxr-xr-x 1 root root 39616 Mar 1 2019 pwd lrwxrwxrwx 1 root root 4 Apr 18 2019 rbash -> bash -rwxr-xr-x 1 root root 47776 Mar 1 2019 readlink -rwxr-xr-x 1 root root 68416 Mar 1 2019 rm -rwxr-xr-x 1 root root 47776 Mar 1 2019 rmdir -rwxr-xr-x 1 root root 23312 Jan 22 2019 run-parts -rwxr-xr-x 1 root root 122224 Dec 23 2018 sed lrwxrwxrwx 1 root root 4 Jan 22 15:16 sh -> bash lrwxrwxrwx 1 root root 4 Jan 10 04:47 sh.distrib -> dash -rwxr-xr-x 1 root root 39552 Mar 1 2019 sleep -rwxr-xr-x 1 root root 80672 Mar 1 2019 stty -rwsr-xr-x 1 root root 63568 Jan 10 2019 su -rwxr-xr-x 1 root root 35488 Mar 1 2019 sync -rwxr-xr-x 1 root root 445560 Apr 24 2019 tar -rwxr-xr-x 1 root root 14440 Jan 22 2019 tempfile -rwxr-xr-x 1 root root 97152 Mar 1 2019 touch -rwxr-xr-x 1 root root 35424 Mar 1 2019 true -rwxr-xr-x 1 root root 14328 Apr 23 2020 ulockmgr_server -rwsr-xr-x 1 root root 34888 Jan 10 2019 umount -rwxr-xr-x 1 root root 39584 Mar 1 2019 uname -rwxr-xr-x 2 root root 2345 Jan 6 2019 uncompress -rwxr-xr-x 1 root root 138856 Mar 1 2019 vdir -rwxr-xr-x 1 root root 34896 Jan 10 2019 wdctl -rwxr-xr-x 1 root root 946 Jan 22 2019 which lrwxrwxrwx 1 root root 8 Sep 27 2018 ypdomainname -> hostname -rwxr-xr-x 1 root root 1983 Jan 6 2019 zcat -rwxr-xr-x 1 root root 1677 Jan 6 2019 zcmp -rwxr-xr-x 1 root root 5879 Jan 6 2019 zdiff -rwxr-xr-x 1 root root 29 Jan 6 2019 zegrep -rwxr-xr-x 1 root root 29 Jan 6 2019 zfgrep -rwxr-xr-x 1 root root 2080 Jan 6 2019 zforce -rwxr-xr-x 1 root root 7584 Jan 6 2019 zgrep -rwxr-xr-x 1 root root 2205 Jan 6 2019 zless -rwxr-xr-x 1 root root 1841 Jan 6 2019 zmore -rwxr-xr-x 1 root root 4552 Jan 6 2019 znew I: user script /srv/workspace/pbuilder/33056/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: amd64 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: debhelper (>= 8), gfortran, libblas-dev, libfftw3-dev, liblapack-dev, libxc-dev, mpi-default-bin, mpi-default-dev, pkg-config, texlive-latex-base dpkg-deb: building package 'pbuilder-satisfydepends-dummy' in '/tmp/satisfydepends-aptitude/pbuilder-satisfydepends-dummy.deb'. Selecting previously unselected package pbuilder-satisfydepends-dummy. (Reading database ... 19195 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 debhelper (>= 8); however: Package debhelper is not installed. pbuilder-satisfydepends-dummy depends on gfortran; however: Package gfortran is not installed. pbuilder-satisfydepends-dummy depends on libblas-dev; however: Package libblas-dev is not installed. pbuilder-satisfydepends-dummy depends on libfftw3-dev; however: Package libfftw3-dev is not installed. pbuilder-satisfydepends-dummy depends on liblapack-dev; however: Package liblapack-dev is not installed. pbuilder-satisfydepends-dummy depends on libxc-dev; however: Package libxc-dev is not installed. pbuilder-satisfydepends-dummy depends on mpi-default-bin; however: Package mpi-default-bin is not installed. pbuilder-satisfydepends-dummy depends on mpi-default-dev; however: Package mpi-default-dev is not installed. pbuilder-satisfydepends-dummy depends on pkg-config; however: Package pkg-config is not installed. pbuilder-satisfydepends-dummy depends on texlive-latex-base; however: Package texlive-latex-base 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} bsdmainutils{a} debhelper{a} dh-autoreconf{a} dh-strip-nondeterminism{a} dwz{a} file{a} fontconfig-config{a} fonts-dejavu-core{a} fonts-lmodern{a} gettext{a} gettext-base{a} gfortran{a} gfortran-8{a} groff-base{a} ibverbs-providers{a} intltool-debian{a} libarchive-zip-perl{a} libavahi-client3{a} libavahi-common-data{a} libavahi-common3{a} libblas-dev{a} libblas3{a} libbrotli1{a} libbsd0{a} libcairo2{a} libcroco3{a} libcups2{a} libcupsimage2{a} libdbus-1-3{a} libedit2{a} libelf1{a} libevent-2.1-6{a} libevent-core-2.1-6{a} libevent-pthreads-2.1-6{a} libexpat1{a} libfabric1{a} libfftw3-bin{a} libfftw3-dev{a} libfftw3-double3{a} libfftw3-long3{a} libfftw3-quad3{a} libfftw3-single3{a} libfile-stripnondeterminism-perl{a} libfontconfig1{a} libfreetype6{a} libgfortran-8-dev{a} libgfortran5{a} libglib2.0-0{a} libgraphite2-3{a} libgs9{a} libgs9-common{a} libgssapi-krb5-2{a} libharfbuzz-icu0{a} libharfbuzz0b{a} libhwloc-dev{a} libhwloc-plugins{a} libhwloc5{a} libibverbs-dev{a} libibverbs1{a} libice6{a} libicu63{a} libidn11{a} libijs-0.35{a} libjbig0{a} libjbig2dec0{a} libjpeg62-turbo{a} libk5crypto3{a} libkeyutils1{a} libkpathsea6{a} libkrb5-3{a} libkrb5support0{a} liblapack-dev{a} liblapack3{a} liblcms2-2{a} libltdl-dev{a} libltdl7{a} libmagic-mgc{a} libmagic1{a} libncurses6{a} libnl-3-200{a} libnl-3-dev{a} libnl-route-3-200{a} libnl-route-3-dev{a} libnuma-dev{a} libnuma1{a} libopenjp2-7{a} libopenmpi-dev{a} libopenmpi3{a} libpaper-utils{a} libpaper1{a} libpciaccess0{a} libpipeline1{a} libpixman-1-0{a} libpmix2{a} libpng16-16{a} libpotrace0{a} libpsm-infinipath1{a} libpsm2-2{a} libptexenc1{a} librdmacm1{a} libsigsegv2{a} libsm6{a} libssl1.1{a} libsynctex2{a} libteckit0{a} libtexlua52{a} libtexlua53{a} libtexluajit2{a} libtiff5{a} libtool{a} libuchardet0{a} libwebp6{a} libwoff1{a} libx11-6{a} libx11-data{a} libxau6{a} libxaw7{a} libxc-dev{a} libxc5{a} libxcb-render0{a} libxcb-shm0{a} libxcb1{a} libxdmcp6{a} libxext6{a} libxi6{a} libxml2{a} libxmu6{a} libxpm4{a} libxrender1{a} libxt6{a} libxxhash0{a} libzzip-0-13{a} lsb-base{a} m4{a} man-db{a} mpi-default-bin{a} mpi-default-dev{a} ocl-icd-libopencl1{a} openmpi-bin{a} openmpi-common{a} openssh-client{a} pkg-config{a} po-debconf{a} poppler-data{a} sensible-utils{a} t1utils{a} tex-common{a} texlive-base{a} texlive-binaries{a} texlive-latex-base{a} ucf{a} x11-common{a} xdg-utils{a} The following packages are RECOMMENDED but will NOT be installed: curl dbus fonts-droid-fallback krb5-locales libarchive-cpio-perl libcoarrays-openmpi-dev libcupsfilters1 libfile-mimeinfo-perl libglib2.0-data libgpm2 libmail-sendmail-perl libnet-dbus-perl libx11-protocol-perl lmodern lynx shared-mime-info wget x11-utils x11-xserver-utils xauth xdg-user-dirs 0 packages upgraded, 157 newly installed, 0 to remove and 0 not upgraded. Need to get 112 MB of archives. After unpacking 411 MB will be used. Writing extended state information... Get: 1 http://deb.debian.org/debian buster/main amd64 libbsd0 amd64 0.9.1-2 [99.5 kB] Get: 2 http://deb.debian.org/debian buster/main amd64 bsdmainutils amd64 11.1.2+b1 [191 kB] Get: 3 http://deb.debian.org/debian buster/main amd64 libuchardet0 amd64 0.0.6-3 [64.9 kB] Get: 4 http://deb.debian.org/debian buster/main amd64 groff-base amd64 1.22.4-3 [916 kB] Get: 5 http://deb.debian.org/debian buster/main amd64 libpipeline1 amd64 1.5.1-2 [31.2 kB] Get: 6 http://deb.debian.org/debian buster/main amd64 man-db amd64 2.8.5-2 [1274 kB] Get: 7 http://deb.debian.org/debian buster/main amd64 poppler-data all 0.4.9-2 [1473 kB] Get: 8 http://deb.debian.org/debian buster/main amd64 sensible-utils all 0.0.12 [15.8 kB] Get: 9 http://deb.debian.org/debian buster/main amd64 ucf all 3.0038+nmu1 [69.0 kB] Get: 10 http://deb.debian.org/debian buster/main amd64 tex-common all 6.11 [53.1 kB] Get: 11 http://deb.debian.org/debian buster/main amd64 libmagic-mgc amd64 1:5.35-4+deb10u1 [242 kB] Get: 12 http://deb.debian.org/debian buster/main amd64 libmagic1 amd64 1:5.35-4+deb10u1 [117 kB] Get: 13 http://deb.debian.org/debian buster/main amd64 file amd64 1:5.35-4+deb10u1 [66.4 kB] Get: 14 http://deb.debian.org/debian buster/main amd64 gettext-base amd64 0.19.8.1-9 [123 kB] Get: 15 http://deb.debian.org/debian buster/main amd64 libedit2 amd64 3.1-20181209-1 [94.0 kB] Get: 16 http://deb.debian.org/debian buster/main amd64 libkeyutils1 amd64 1.6-6 [15.0 kB] Get: 17 http://deb.debian.org/debian buster/main amd64 libkrb5support0 amd64 1.17-3+deb10u1 [65.8 kB] Get: 18 http://deb.debian.org/debian buster/main amd64 libk5crypto3 amd64 1.17-3+deb10u1 [122 kB] Get: 19 http://deb.debian.org/debian buster/main amd64 libssl1.1 amd64 1.1.1d-0+deb10u3 [1538 kB] Get: 20 http://deb.debian.org/debian buster/main amd64 libkrb5-3 amd64 1.17-3+deb10u1 [369 kB] Get: 21 http://deb.debian.org/debian buster/main amd64 libgssapi-krb5-2 amd64 1.17-3+deb10u1 [158 kB] Get: 22 http://deb.debian.org/debian buster/main amd64 openssh-client amd64 1:7.9p1-10+deb10u2 [782 kB] Get: 23 http://deb.debian.org/debian buster/main amd64 libsigsegv2 amd64 2.12-2 [32.8 kB] Get: 24 http://deb.debian.org/debian buster/main amd64 m4 amd64 1.4.18-2 [203 kB] Get: 25 http://deb.debian.org/debian buster/main amd64 autoconf all 2.69-11 [341 kB] Get: 26 http://deb.debian.org/debian buster/main amd64 autotools-dev all 20180224.1 [77.0 kB] Get: 27 http://deb.debian.org/debian buster/main amd64 automake all 1:1.16.1-4 [771 kB] Get: 28 http://deb.debian.org/debian buster/main amd64 autopoint all 0.19.8.1-9 [434 kB] Get: 29 http://deb.debian.org/debian buster/main amd64 libtool all 2.4.6-9 [547 kB] Get: 30 http://deb.debian.org/debian buster/main amd64 dh-autoreconf all 19 [16.9 kB] Get: 31 http://deb.debian.org/debian buster/main amd64 libarchive-zip-perl all 1.64-1 [96.8 kB] Get: 32 http://deb.debian.org/debian buster/main amd64 libfile-stripnondeterminism-perl all 1.1.2-1 [19.8 kB] Get: 33 http://deb.debian.org/debian buster/main amd64 dh-strip-nondeterminism all 1.1.2-1 [13.0 kB] Get: 34 http://deb.debian.org/debian buster/main amd64 libelf1 amd64 0.176-1.1 [161 kB] Get: 35 http://deb.debian.org/debian buster/main amd64 dwz amd64 0.12-3 [78.0 kB] Get: 36 http://deb.debian.org/debian buster/main amd64 libglib2.0-0 amd64 2.58.3-2+deb10u2 [1258 kB] Get: 37 http://deb.debian.org/debian buster/main amd64 libicu63 amd64 63.1-6+deb10u1 [8300 kB] Get: 38 http://deb.debian.org/debian buster/main amd64 libxml2 amd64 2.9.4+dfsg1-7+deb10u1 [689 kB] Get: 39 http://deb.debian.org/debian buster/main amd64 libcroco3 amd64 0.6.12-3 [145 kB] Get: 40 http://deb.debian.org/debian buster/main amd64 libncurses6 amd64 6.1+20181013-2+deb10u2 [102 kB] Get: 41 http://deb.debian.org/debian buster/main amd64 gettext amd64 0.19.8.1-9 [1303 kB] Get: 42 http://deb.debian.org/debian buster/main amd64 intltool-debian all 0.35.0+20060710.5 [26.8 kB] Get: 43 http://deb.debian.org/debian buster/main amd64 po-debconf all 1.0.21 [248 kB] Get: 44 http://deb.debian.org/debian buster/main amd64 debhelper all 12.1.1 [1016 kB] Get: 45 http://deb.debian.org/debian buster/main amd64 fonts-dejavu-core all 2.37-1 [1068 kB] Get: 46 http://deb.debian.org/debian buster/main amd64 fontconfig-config all 2.13.1-2 [280 kB] Get: 47 http://deb.debian.org/debian buster/main amd64 fonts-lmodern all 2.004.5-6 [4539 kB] Get: 48 http://deb.debian.org/debian buster/main amd64 libgfortran5 amd64 8.3.0-6 [581 kB] Get: 49 http://deb.debian.org/debian buster/main amd64 libgfortran-8-dev amd64 8.3.0-6 [616 kB] Get: 50 http://deb.debian.org/debian buster/main amd64 gfortran-8 amd64 8.3.0-6 [9375 kB] Get: 51 http://deb.debian.org/debian buster/main amd64 gfortran amd64 4:8.3.0-1 [1432 B] Get: 52 http://deb.debian.org/debian buster/main amd64 libnl-3-200 amd64 3.4.0-1 [63.0 kB] Get: 53 http://deb.debian.org/debian buster/main amd64 libnl-route-3-200 amd64 3.4.0-1 [162 kB] Get: 54 http://deb.debian.org/debian buster/main amd64 libibverbs1 amd64 22.1-1 [51.2 kB] Get: 55 http://deb.debian.org/debian buster/main amd64 ibverbs-providers amd64 22.1-1 [187 kB] Get: 56 http://deb.debian.org/debian buster/main amd64 libavahi-common-data amd64 0.7-4+b1 [122 kB] Get: 57 http://deb.debian.org/debian buster/main amd64 libavahi-common3 amd64 0.7-4+b1 [54.6 kB] Get: 58 http://deb.debian.org/debian buster/main amd64 libdbus-1-3 amd64 1.12.20-0+deb10u1 [215 kB] Get: 59 http://deb.debian.org/debian buster/main amd64 libavahi-client3 amd64 0.7-4+b1 [58.1 kB] Get: 60 http://deb.debian.org/debian buster/main amd64 libblas3 amd64 3.8.0-2 [148 kB] Get: 61 http://deb.debian.org/debian buster/main amd64 libblas-dev amd64 3.8.0-2 [154 kB] Get: 62 http://deb.debian.org/debian buster/main amd64 libbrotli1 amd64 1.0.7-2 [270 kB] Get: 63 http://deb.debian.org/debian buster/main amd64 libexpat1 amd64 2.2.6-2+deb10u1 [106 kB] Get: 64 http://deb.debian.org/debian buster/main amd64 libpng16-16 amd64 1.6.36-6 [292 kB] Get: 65 http://deb.debian.org/debian buster/main amd64 libfreetype6 amd64 2.9.1-3+deb10u2 [380 kB] Get: 66 http://deb.debian.org/debian buster/main amd64 libfontconfig1 amd64 2.13.1-2 [346 kB] Get: 67 http://deb.debian.org/debian buster/main amd64 libpixman-1-0 amd64 0.36.0-1 [537 kB] Get: 68 http://deb.debian.org/debian buster/main amd64 libxau6 amd64 1:1.0.8-1+b2 [19.9 kB] Get: 69 http://deb.debian.org/debian buster/main amd64 libxdmcp6 amd64 1:1.1.2-3 [26.3 kB] Get: 70 http://deb.debian.org/debian buster/main amd64 libxcb1 amd64 1.13.1-2 [137 kB] Get: 71 http://deb.debian.org/debian buster/main amd64 libx11-data all 2:1.6.7-1+deb10u1 [294 kB] Get: 72 http://deb.debian.org/debian buster/main amd64 libx11-6 amd64 2:1.6.7-1+deb10u1 [757 kB] Get: 73 http://deb.debian.org/debian buster/main amd64 libxcb-render0 amd64 1.13.1-2 [109 kB] Get: 74 http://deb.debian.org/debian buster/main amd64 libxcb-shm0 amd64 1.13.1-2 [99.2 kB] Get: 75 http://deb.debian.org/debian buster/main amd64 libxext6 amd64 2:1.3.3-1+b2 [52.5 kB] Get: 76 http://deb.debian.org/debian buster/main amd64 libxrender1 amd64 1:0.9.10-1 [33.0 kB] Get: 77 http://deb.debian.org/debian buster/main amd64 libcairo2 amd64 1.16.0-4 [689 kB] Get: 78 http://deb.debian.org/debian buster/main amd64 libcups2 amd64 2.2.10-6+deb10u4 [324 kB] Get: 79 http://deb.debian.org/debian buster/main amd64 libcupsimage2 amd64 2.2.10-6+deb10u4 [133 kB] Get: 80 http://deb.debian.org/debian buster/main amd64 libevent-2.1-6 amd64 2.1.8-stable-4 [177 kB] Get: 81 http://deb.debian.org/debian buster/main amd64 libevent-core-2.1-6 amd64 2.1.8-stable-4 [129 kB] Get: 82 http://deb.debian.org/debian buster/main amd64 libevent-pthreads-2.1-6 amd64 2.1.8-stable-4 [47.9 kB] Get: 83 http://deb.debian.org/debian buster/main amd64 libpsm-infinipath1 amd64 3.3+20.604758e7-6 [168 kB] Get: 84 http://deb.debian.org/debian buster/main amd64 libnuma1 amd64 2.0.12-1 [26.2 kB] Get: 85 http://deb.debian.org/debian buster/main amd64 libpsm2-2 amd64 11.2.78-1 [177 kB] Get: 86 http://deb.debian.org/debian buster/main amd64 librdmacm1 amd64 22.1-1 [65.3 kB] Get: 87 http://deb.debian.org/debian buster/main amd64 libfabric1 amd64 1.6.2-3 [396 kB] Get: 88 http://deb.debian.org/debian buster/main amd64 libfftw3-double3 amd64 3.3.8-2 [733 kB] Get: 89 http://deb.debian.org/debian buster/main amd64 libfftw3-long3 amd64 3.3.8-2 [319 kB] Get: 90 http://deb.debian.org/debian buster/main amd64 libfftw3-quad3 amd64 3.3.8-2 [558 kB] Get: 91 http://deb.debian.org/debian buster/main amd64 libfftw3-single3 amd64 3.3.8-2 [762 kB] Get: 92 http://deb.debian.org/debian buster/main amd64 libfftw3-bin amd64 3.3.8-2 [50.7 kB] Get: 93 http://deb.debian.org/debian buster/main amd64 libfftw3-dev amd64 3.3.8-2 [2106 kB] Get: 94 http://deb.debian.org/debian buster/main amd64 libgraphite2-3 amd64 1.3.13-7 [80.7 kB] Get: 95 http://deb.debian.org/debian buster/main amd64 libgs9-common all 9.27~dfsg-2+deb10u4 [5136 kB] Get: 96 http://deb.debian.org/debian buster/main amd64 libidn11 amd64 1.33-2.2 [116 kB] Get: 97 http://deb.debian.org/debian buster/main amd64 libijs-0.35 amd64 0.35-14 [18.3 kB] Get: 98 http://deb.debian.org/debian buster/main amd64 libjbig2dec0 amd64 0.16-1 [62.0 kB] Get: 99 http://deb.debian.org/debian buster/main amd64 libjpeg62-turbo amd64 1:1.5.2-2+deb10u1 [133 kB] Get: 100 http://deb.debian.org/debian buster/main amd64 liblcms2-2 amd64 2.9-3 [145 kB] Get: 101 http://deb.debian.org/debian buster/main amd64 libopenjp2-7 amd64 2.3.0-2+deb10u1 [158 kB] Get: 102 http://deb.debian.org/debian buster/main amd64 libpaper1 amd64 1.1.28 [21.3 kB] Get: 103 http://deb.debian.org/debian buster/main amd64 libjbig0 amd64 2.1-3.1+b2 [31.0 kB] Get: 104 http://deb.debian.org/debian buster/main amd64 libwebp6 amd64 0.6.1-2 [263 kB] Get: 105 http://deb.debian.org/debian buster/main amd64 libtiff5 amd64 4.1.0+git191117-2~deb10u1 [271 kB] Get: 106 http://deb.debian.org/debian buster/main amd64 libgs9 amd64 9.27~dfsg-2+deb10u4 [2195 kB] Get: 107 http://deb.debian.org/debian buster/main amd64 libharfbuzz0b amd64 2.3.1-1 [1187 kB] Get: 108 http://deb.debian.org/debian buster/main amd64 libharfbuzz-icu0 amd64 2.3.1-1 [834 kB] Get: 109 http://deb.debian.org/debian buster/main amd64 libltdl7 amd64 2.4.6-9 [390 kB] Get: 110 http://deb.debian.org/debian buster/main amd64 libhwloc5 amd64 1.11.12-3 [111 kB] Get: 111 http://deb.debian.org/debian buster/main amd64 libnuma-dev amd64 2.0.12-1 [39.2 kB] Get: 112 http://deb.debian.org/debian buster/main amd64 libltdl-dev amd64 2.4.6-9 [162 kB] Get: 113 http://deb.debian.org/debian buster/main amd64 libhwloc-dev amd64 1.11.12-3 [175 kB] Get: 114 http://deb.debian.org/debian buster/main amd64 libpciaccess0 amd64 0.14-1 [53.5 kB] Get: 115 http://deb.debian.org/debian buster/main amd64 ocl-icd-libopencl1 amd64 2.2.12-2 [37.5 kB] Get: 116 http://deb.debian.org/debian buster/main amd64 libhwloc-plugins amd64 1.11.12-3 [17.4 kB] Get: 117 http://deb.debian.org/debian buster/main amd64 libnl-3-dev amd64 3.4.0-1 [102 kB] Get: 118 http://deb.debian.org/debian buster/main amd64 libnl-route-3-dev amd64 3.4.0-1 [177 kB] Get: 119 http://deb.debian.org/debian buster/main amd64 libibverbs-dev amd64 22.1-1 [362 kB] Get: 120 http://deb.debian.org/debian buster/main amd64 lsb-base all 10.2019051400 [28.4 kB] Get: 121 http://deb.debian.org/debian buster/main amd64 x11-common all 1:7.7+19 [251 kB] Get: 122 http://deb.debian.org/debian buster/main amd64 libice6 amd64 2:1.0.9-2 [58.7 kB] Get: 123 http://deb.debian.org/debian buster/main amd64 libkpathsea6 amd64 2018.20181218.49446-1 [167 kB] Get: 124 http://deb.debian.org/debian buster/main amd64 liblapack3 amd64 3.8.0-2 [2110 kB] Get: 125 http://deb.debian.org/debian buster/main amd64 liblapack-dev amd64 3.8.0-2 [2140 kB] Get: 126 http://deb.debian.org/debian buster/main amd64 libpmix2 amd64 3.1.2-3 [498 kB] Get: 127 http://deb.debian.org/debian buster/main amd64 libopenmpi3 amd64 3.1.3-11 [2191 kB] Get: 128 http://deb.debian.org/debian buster/main amd64 openmpi-common all 3.1.3-11 [165 kB] Get: 129 http://deb.debian.org/debian buster/main amd64 openmpi-bin amd64 3.1.3-11 [200 kB] Get: 130 http://deb.debian.org/debian buster/main amd64 libopenmpi-dev amd64 3.1.3-11 [974 kB] Get: 131 http://deb.debian.org/debian buster/main amd64 libpaper-utils amd64 1.1.28 [18.0 kB] Get: 132 http://deb.debian.org/debian buster/main amd64 libpotrace0 amd64 1.15-1 [26.3 kB] Get: 133 http://deb.debian.org/debian buster/main amd64 libptexenc1 amd64 2018.20181218.49446-1 [61.0 kB] Get: 134 http://deb.debian.org/debian buster/main amd64 libsm6 amd64 2:1.2.3-1 [35.1 kB] Get: 135 http://deb.debian.org/debian buster/main amd64 libsynctex2 amd64 2018.20181218.49446-1 [80.5 kB] Get: 136 http://deb.debian.org/debian buster/main amd64 libteckit0 amd64 2.5.8+ds2-5 [318 kB] Get: 137 http://deb.debian.org/debian buster/main amd64 libtexlua52 amd64 2018.20181218.49446-1 [112 kB] Get: 138 http://deb.debian.org/debian buster/main amd64 libtexlua53 amd64 2018.20181218.49446-1 [126 kB] Get: 139 http://deb.debian.org/debian buster/main amd64 libtexluajit2 amd64 2018.20181218.49446-1 [256 kB] Get: 140 http://deb.debian.org/debian buster/main amd64 libwoff1 amd64 1.0.2-1 [43.2 kB] Get: 141 http://deb.debian.org/debian buster/main amd64 libxt6 amd64 1:1.1.5-1+b3 [190 kB] Get: 142 http://deb.debian.org/debian buster/main amd64 libxmu6 amd64 2:1.1.2-2+b3 [60.8 kB] Get: 143 http://deb.debian.org/debian buster/main amd64 libxpm4 amd64 1:3.5.12-1 [49.1 kB] Get: 144 http://deb.debian.org/debian buster/main amd64 libxaw7 amd64 2:1.0.13-1+b2 [201 kB] Get: 145 http://deb.debian.org/debian buster/main amd64 libxc5 amd64 4.2.3-3 [1996 kB] Get: 146 http://deb.debian.org/debian buster/main amd64 libxc-dev amd64 4.2.3-3 [3282 kB] Get: 147 http://deb.debian.org/debian buster/main amd64 libxi6 amd64 2:1.7.9-1 [82.6 kB] Get: 148 http://deb.debian.org/debian buster/main amd64 libxxhash0 amd64 0.6.5-2 [7156 B] Get: 149 http://deb.debian.org/debian buster/main amd64 libzzip-0-13 amd64 0.13.62-3.2 [55.4 kB] Get: 150 http://deb.debian.org/debian buster/main amd64 mpi-default-bin amd64 1.13 [4672 B] Get: 151 http://deb.debian.org/debian buster/main amd64 mpi-default-dev amd64 1.13 [5476 B] Get: 152 http://deb.debian.org/debian buster/main amd64 pkg-config amd64 0.29-6 [63.5 kB] Get: 153 http://deb.debian.org/debian buster/main amd64 t1utils amd64 1.41-3 [62.3 kB] Get: 154 http://deb.debian.org/debian buster/main amd64 texlive-binaries amd64 2018.20181218.49446-1 [11.3 MB] Get: 155 http://deb.debian.org/debian buster/main amd64 xdg-utils all 1.1.3-1+deb10u1 [73.7 kB] Get: 156 http://deb.debian.org/debian buster/main amd64 texlive-base all 2018.20190227-2 [19.7 MB] Get: 157 http://deb.debian.org/debian buster/main amd64 texlive-latex-base all 2018.20190227-2 [984 kB] Fetched 112 MB in 2s (65.9 MB/s) debconf: delaying package configuration, since apt-utils is not installed Selecting previously unselected package libbsd0:amd64. (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 ... 19195 files and directories currently installed.) Preparing to unpack .../000-libbsd0_0.9.1-2_amd64.deb ... Unpacking libbsd0:amd64 (0.9.1-2) ... Selecting previously unselected package bsdmainutils. Preparing to unpack .../001-bsdmainutils_11.1.2+b1_amd64.deb ... Unpacking bsdmainutils (11.1.2+b1) ... Selecting previously unselected package libuchardet0:amd64. Preparing to unpack .../002-libuchardet0_0.0.6-3_amd64.deb ... Unpacking libuchardet0:amd64 (0.0.6-3) ... Selecting previously unselected package groff-base. Preparing to unpack .../003-groff-base_1.22.4-3_amd64.deb ... Unpacking groff-base (1.22.4-3) ... Selecting previously unselected package libpipeline1:amd64. Preparing to unpack .../004-libpipeline1_1.5.1-2_amd64.deb ... Unpacking libpipeline1:amd64 (1.5.1-2) ... Selecting previously unselected package man-db. Preparing to unpack .../005-man-db_2.8.5-2_amd64.deb ... Unpacking man-db (2.8.5-2) ... Selecting previously unselected package poppler-data. Preparing to unpack .../006-poppler-data_0.4.9-2_all.deb ... Unpacking poppler-data (0.4.9-2) ... Selecting previously unselected package sensible-utils. Preparing to unpack .../007-sensible-utils_0.0.12_all.deb ... Unpacking sensible-utils (0.0.12) ... Selecting previously unselected package ucf. Preparing to unpack .../008-ucf_3.0038+nmu1_all.deb ... Moving old data out of the way Unpacking ucf (3.0038+nmu1) ... Selecting previously unselected package tex-common. Preparing to unpack .../009-tex-common_6.11_all.deb ... Unpacking tex-common (6.11) ... Selecting previously unselected package libmagic-mgc. Preparing to unpack .../010-libmagic-mgc_1%3a5.35-4+deb10u1_amd64.deb ... Unpacking libmagic-mgc (1:5.35-4+deb10u1) ... Selecting previously unselected package libmagic1:amd64. Preparing to unpack .../011-libmagic1_1%3a5.35-4+deb10u1_amd64.deb ... Unpacking libmagic1:amd64 (1:5.35-4+deb10u1) ... Selecting previously unselected package file. Preparing to unpack .../012-file_1%3a5.35-4+deb10u1_amd64.deb ... Unpacking file (1:5.35-4+deb10u1) ... Selecting previously unselected package gettext-base. Preparing to unpack .../013-gettext-base_0.19.8.1-9_amd64.deb ... Unpacking gettext-base (0.19.8.1-9) ... Selecting previously unselected package libedit2:amd64. Preparing to unpack .../014-libedit2_3.1-20181209-1_amd64.deb ... Unpacking libedit2:amd64 (3.1-20181209-1) ... Selecting previously unselected package libkeyutils1:amd64. Preparing to unpack .../015-libkeyutils1_1.6-6_amd64.deb ... Unpacking libkeyutils1:amd64 (1.6-6) ... Selecting previously unselected package libkrb5support0:amd64. Preparing to unpack .../016-libkrb5support0_1.17-3+deb10u1_amd64.deb ... Unpacking libkrb5support0:amd64 (1.17-3+deb10u1) ... Selecting previously unselected package libk5crypto3:amd64. Preparing to unpack .../017-libk5crypto3_1.17-3+deb10u1_amd64.deb ... Unpacking libk5crypto3:amd64 (1.17-3+deb10u1) ... Selecting previously unselected package libssl1.1:amd64. Preparing to unpack .../018-libssl1.1_1.1.1d-0+deb10u3_amd64.deb ... Unpacking libssl1.1:amd64 (1.1.1d-0+deb10u3) ... Selecting previously unselected package libkrb5-3:amd64. Preparing to unpack .../019-libkrb5-3_1.17-3+deb10u1_amd64.deb ... Unpacking libkrb5-3:amd64 (1.17-3+deb10u1) ... Selecting previously unselected package libgssapi-krb5-2:amd64. Preparing to unpack .../020-libgssapi-krb5-2_1.17-3+deb10u1_amd64.deb ... Unpacking libgssapi-krb5-2:amd64 (1.17-3+deb10u1) ... Selecting previously unselected package openssh-client. Preparing to unpack .../021-openssh-client_1%3a7.9p1-10+deb10u2_amd64.deb ... Unpacking openssh-client (1:7.9p1-10+deb10u2) ... Selecting previously unselected package libsigsegv2:amd64. Preparing to unpack .../022-libsigsegv2_2.12-2_amd64.deb ... Unpacking libsigsegv2:amd64 (2.12-2) ... Selecting previously unselected package m4. Preparing to unpack .../023-m4_1.4.18-2_amd64.deb ... Unpacking m4 (1.4.18-2) ... Selecting previously unselected package autoconf. Preparing to unpack .../024-autoconf_2.69-11_all.deb ... Unpacking autoconf (2.69-11) ... Selecting previously unselected package autotools-dev. Preparing to unpack .../025-autotools-dev_20180224.1_all.deb ... Unpacking autotools-dev (20180224.1) ... Selecting previously unselected package automake. Preparing to unpack .../026-automake_1%3a1.16.1-4_all.deb ... Unpacking automake (1:1.16.1-4) ... Selecting previously unselected package autopoint. Preparing to unpack .../027-autopoint_0.19.8.1-9_all.deb ... Unpacking autopoint (0.19.8.1-9) ... Selecting previously unselected package libtool. Preparing to unpack .../028-libtool_2.4.6-9_all.deb ... Unpacking libtool (2.4.6-9) ... Selecting previously unselected package dh-autoreconf. Preparing to unpack .../029-dh-autoreconf_19_all.deb ... Unpacking dh-autoreconf (19) ... Selecting previously unselected package libarchive-zip-perl. Preparing to unpack .../030-libarchive-zip-perl_1.64-1_all.deb ... Unpacking libarchive-zip-perl (1.64-1) ... Selecting previously unselected package libfile-stripnondeterminism-perl. Preparing to unpack .../031-libfile-stripnondeterminism-perl_1.1.2-1_all.deb ... Unpacking libfile-stripnondeterminism-perl (1.1.2-1) ... Selecting previously unselected package dh-strip-nondeterminism. Preparing to unpack .../032-dh-strip-nondeterminism_1.1.2-1_all.deb ... Unpacking dh-strip-nondeterminism (1.1.2-1) ... Selecting previously unselected package libelf1:amd64. Preparing to unpack .../033-libelf1_0.176-1.1_amd64.deb ... Unpacking libelf1:amd64 (0.176-1.1) ... Selecting previously unselected package dwz. Preparing to unpack .../034-dwz_0.12-3_amd64.deb ... Unpacking dwz (0.12-3) ... Selecting previously unselected package libglib2.0-0:amd64. Preparing to unpack .../035-libglib2.0-0_2.58.3-2+deb10u2_amd64.deb ... Unpacking libglib2.0-0:amd64 (2.58.3-2+deb10u2) ... Selecting previously unselected package libicu63:amd64. Preparing to unpack .../036-libicu63_63.1-6+deb10u1_amd64.deb ... Unpacking libicu63:amd64 (63.1-6+deb10u1) ... Selecting previously unselected package libxml2:amd64. Preparing to unpack .../037-libxml2_2.9.4+dfsg1-7+deb10u1_amd64.deb ... Unpacking libxml2:amd64 (2.9.4+dfsg1-7+deb10u1) ... Selecting previously unselected package libcroco3:amd64. 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Reading state information... fakeroot is already the newest version (1.23-1). 0 upgraded, 0 newly installed, 0 to remove and 0 not upgraded. I: Building the package I: Running cd /build/elkcode-5.4.24/ && env PATH="/usr/sbin:/usr/bin:/sbin:/bin:/usr/games:/i/capture/the/path" HOME="/nonexistent/second-build" dpkg-buildpackage -us -uc -b dpkg-buildpackage: info: source package elkcode dpkg-buildpackage: info: source version 5.4.24-2 dpkg-buildpackage: info: source distribution unstable dpkg-buildpackage: info: source changed by Michael Banck dpkg-source --before-build . dpkg-buildpackage: info: host architecture amd64 fakeroot debian/rules clean dh clean dh: Compatibility levels before 9 are deprecated (level 8 in use) dh_auto_clean dh_auto_clean: Compatibility levels before 9 are deprecated (level 8 in use) make -j1 clean make[1]: Entering directory '/build/elkcode-5.4.24' cd src; make cleanall make[2]: Entering directory '/build/elkcode-5.4.24/src' cd BLAS; make clean make[3]: Entering directory '/build/elkcode-5.4.24/src/BLAS' rm -f *.o *.mod *~ *.a ifc* *.gcno gmon.out make[3]: Leaving directory '/build/elkcode-5.4.24/src/BLAS' cd LAPACK; make clean make[3]: Entering directory '/build/elkcode-5.4.24/src/LAPACK' rm -f *.o *.mod *~ *.a ifc* *.gcno gmon.out make[3]: Leaving directory '/build/elkcode-5.4.24/src/LAPACK' cd fftlib; make clean make[3]: Entering directory '/build/elkcode-5.4.24/src/fftlib' rm -f *.o *.mod *~ *.a ifc* *.gcno make[3]: Leaving directory '/build/elkcode-5.4.24/src/fftlib' make clean make[3]: Entering directory '/build/elkcode-5.4.24/src' rm -f *.o *.mod *~ *.a ifc* *.gcno gmon.out *.aux *.dvi *.log \ elk.pdf elk.out elk.lst *.tex *.toc elk make[3]: Leaving directory '/build/elkcode-5.4.24/src' make[2]: Leaving directory '/build/elkcode-5.4.24/src' cd src/eos; make clean make[2]: Entering directory '/build/elkcode-5.4.24/src/eos' rm -f *.o *.mod *~ fort.* ifc* *.gcno *.OUT gmon.out eos make[2]: Leaving directory '/build/elkcode-5.4.24/src/eos' cd src/spacegroup; make clean make[2]: Entering directory '/build/elkcode-5.4.24/src/spacegroup' rm -f *.o *.mod *~ fort.* ifc* *.gcno *.OUT *.xsf *.ascii gmon.out \ *.aux *.dvi *.log *.pdf *.tex *.toc spacegroup make[2]: Leaving directory '/build/elkcode-5.4.24/src/spacegroup' cd tests; rm -rf test-*/*.OUT test-*/RUNNING test-*/test.log rm -f *.o *.mod *~ fort.* ifc* *.gcno *.exe make[1]: Leaving directory '/build/elkcode-5.4.24' dh_clean dh_clean: Compatibility levels before 9 are deprecated (level 8 in use) debian/rules build dh build dh: Compatibility levels before 9 are deprecated (level 8 in use) dh_update_autotools_config dh_auto_configure dh_auto_configure: Compatibility levels before 9 are deprecated (level 8 in use) debian/rules override_dh_auto_build make[1]: Entering directory '/build/elkcode-5.4.24' dh_auto_build dh_auto_build: Compatibility levels before 9 are deprecated (level 8 in use) make -j1 make[2]: Entering directory '/build/elkcode-5.4.24' cd src; make all make[3]: Entering directory '/build/elkcode-5.4.24/src' mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modmain.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modmpi.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c libxc_funcs.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c libxc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c libxcifc.f90 libxcifc.f90:385:9: integer j,k,id 1 Warning: Unused variable 'j' declared at (1) [-Wunused-variable] libxcifc.f90:101:10: real(8) ta 1 Warning: Unused variable 'ta' declared at (1) [-Wunused-variable] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modxcifc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modfxcifc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c moddftu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modrdm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modphonon.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modscdft.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math 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`dpkg-buildflags --get LDFLAGS` -c modgw.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modulr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modjx.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modomp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mkl_stub.f90 mkl_stub.f90:8:42: subroutine mkl_set_num_threads(num_threads) 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] mkl_stub.f90:14:34: subroutine mkl_set_dynamic(dynamic) 1 Warning: Unused dummy argument 'dynamic' at (1) [-Wunused-dummy-argument] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mkl_init.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c oblas_stub.f90 oblas_stub.f90:8:47: subroutine openblas_set_num_threads(num_threads) 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c oblas_init.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c blis_stub.f90 blis_stub.f90:8:49: subroutine bli_thread_set_num_threads(num_threads) 1 Warning: Unused dummy argument 'num_threads' at (1) [-Wunused-dummy-argument] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c blis_init.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfftifc_fftw.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c elk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zftzf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c wavefmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveqnz.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mixadapt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genidxlo.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findqpt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c linengy.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fintgt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genevfsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveqnfv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmlfv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c olpfv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rhomagsh.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rtozfmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ztorfmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c vecfbz.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potnucl.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potks.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfmtint.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c putevalsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getevalsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdiracint.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdirac.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mixpack.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gengclg.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveqn.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genvmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfint.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfpack.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genbs.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genws.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeqpts.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfmtctof.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genapwlofr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c olpaa.f90 olpaa.f90:52:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_0' at (1) [-Wunused-dummy-argument] olpaa.f90:52:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_1' at (1) [-Wunused-dummy-argument] olpaa.f90:57:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_10' at (1) [-Wunused-dummy-argument] olpaa.f90:57:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_11' at (1) [-Wunused-dummy-argument] olpaa.f90:52:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_2' at (1) [-Wunused-dummy-argument] olpaa.f90:52:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_3' at (1) [-Wunused-dummy-argument] olpaa.f90:52:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_4' at (1) [-Wunused-dummy-argument] olpaa.f90:52:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_5' at (1) [-Wunused-dummy-argument] olpaa.f90:57:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_6' at (1) [-Wunused-dummy-argument] olpaa.f90:57:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_7' at (1) [-Wunused-dummy-argument] olpaa.f90:57:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_8' at (1) [-Wunused-dummy-argument] olpaa.f90:57:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_9' at (1) [-Wunused-dummy-argument] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gradzfmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c spline.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfcmtinp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c symrfir.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sphcrd.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c energynn.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gengkvec.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3frac.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c timesec.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rzfmtinp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmlrad.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c olprad.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c splintp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c splint.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gengvc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfmtinp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zftwfir.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfinp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rndevsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfinp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c z2mm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c z2mctm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c z2mmct.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfcopy.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genjlgpr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sbessel.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findngkmax.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genylmg.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gengclgq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genzrho.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zbsht.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfsht.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rtozflm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rbsht.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfsht.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genylm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genrlm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potxc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potxcmt.f90 potxcmt.f90:33:0: real(8), allocatable :: mag(:,:),bxc(:,:),tau(:,:) Warning: 'bxc.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:33:0: Warning: 'bxc.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:33:0: Warning: 'bxc.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:130:0: t1=sqrt(mag(i,1)**2+mag(i,2)**2+mag(i,3)**2) Warning: 'mag.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:33:0: real(8), allocatable :: mag(:,:),bxc(:,:),tau(:,:) Warning: 'mag.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:33:0: Warning: 'mag.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:38:0: real(8), allocatable :: wx(:),wxup(:),wxdn(:) Warning: 'wxup.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:38:0: Warning: 'wx.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:31:0: real(8), allocatable :: vx(:),vxup(:),vxdn(:) Warning: 'vxup.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:31:0: Warning: 'vxdn.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:31:0: Warning: 'vx.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:33:0: real(8), allocatable :: mag(:,:),bxc(:,:),tau(:,:) Warning: 'tau.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcmt.f90:33:0: Warning: 'tau.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potxcir.f90 potxcir.f90:16:16: integer ispn,idm,i,n 1 Warning: Unused variable 'idm' declared at (1) [-Wunused-variable] potxcir.f90:16:12: integer ispn,idm,i,n 1 Warning: Unused variable 'ispn' declared at (1) [-Wunused-variable] potxcir.f90:25:0: real(8), allocatable :: vx(:),vxup(:),vxdn(:) Warning: 'vxup.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxcir.f90:25:0: Warning: 'vxdn.dim[0].ubound' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c putkmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getkmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c charge.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c chargemt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c factnm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c factr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfmtftoc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gencfun.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genzvclmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rzfinp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfmtpack.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfmtpack.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genvmatk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genvbmatk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmllolo.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ztorflm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfmtinp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rhonorm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gradzf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gradrf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zpotclmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zpotcoul.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfmtconj.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c match.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gencfrc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmlistl.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gengclq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writegclq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genppts.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfmtsm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfirsm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c putevecsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getevecsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genpmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genvsig.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fderiv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gengvec.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfpack.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writepmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getpmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gengqrf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c moke.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sfacinit.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sfacrho.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sfacmag.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gradwf2.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gradwfcr2.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c force.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c forcek.f90 forcek.f90:36:0: complex(8), allocatable :: evecfv(:,:,:),evecsv(:,:) Warning: 'evecsv.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] forcek.f90:36:0: Warning: 'evecsv.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c symrf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c symrfmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c symrvfir.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c symrvf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c symrvfmt.f90 symrvfmt.f90:17:33: real(8) sc(3,3),v1(3),v2(3),t0,t1 1 Warning: Unused variable 't1' declared at (1) [-Wunused-variable] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c initoep.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c oepmain.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c oepresk.f90 oepresk.f90:90:51: call rzadd(npc,z1,zfmt1,dvxmt(:,ias)) 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) [-Wargument-mismatch] oepresk.f90:92:65: call rzadd(npc,z1,zvfmt1(:,idm),dbxmt(:,ias,idm)) 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) [-Wargument-mismatch] oepresk.f90:183:50: call rzadd(npcmt(is),za,zfmt(:,ias),rfmt(:,ias)) 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) [-Wargument-mismatch] oepresk.f90:185:30: call rzadd(ngtot,za,zfir,rfir) 1 Warning: Type mismatch in argument 'zv' at (1); passed COMPLEX(8) to REAL(8) [-Wargument-mismatch] oepresk.f90:28:0: complex(8), allocatable :: zvfmt2(:,:,:),zvfir2(:,:) Warning: 'zvfir2.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] oepresk.f90:28:0: Warning: 'zvfmt2.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] oepresk.f90:26:0: complex(8), allocatable :: zfmt1(:),zvfmt1(:,:) Warning: 'zvfmt1.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c oepvcl.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c oepvclk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genvchi0.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genspchi0.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c epsinv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dbxcplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c vclcore.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genzrm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genzfrm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zftrf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writehmlbse.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmlxbse.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmlxbsek.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmldbse.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmldbsek.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dielectric_bse.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genidxbse.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeevbse.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hartfock.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hflocal.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genwfpw.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writewfpw.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getwfpw.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genexpmat.f90 genexpmat.f90:26:0: complex(8), allocatable :: evecsv1(:,:),evecsv2(:,:) Warning: 'evecsv2.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] genexpmat.f90:26:0: Warning: 'evecsv2.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] genexpmat.f90:26:0: Warning: 'evecsv1.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] genexpmat.f90:26:0: Warning: 'evecsv1.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeexpmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rvfcross.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfplot.f90 rfplot.f90:67:22: call r3frac(epslat,v2) 1 Warning: Unused dummy argument '_formal_0' at (1) [-Wunused-dummy-argument] rfplot.f90:67:22: call r3frac(epslat,v2) 1 Warning: Unused dummy argument '_formal_1' at (1) [-Wunused-dummy-argument] rfplot.f90:87:37: call genrlm(lmaxo,tp,rlm) 1 Warning: Unused dummy argument '_formal_10' at (1) [-Wunused-dummy-argument] rfplot.f90:69:21: call r3mv(avec,v2,v1) 1 Warning: Unused dummy argument '_formal_2' at (1) [-Wunused-dummy-argument] rfplot.f90:69:21: call r3mv(avec,v2,v1) 1 Warning: Unused dummy argument '_formal_3' at (1) [-Wunused-dummy-argument] rfplot.f90:69:21: call r3mv(avec,v2,v1) 1 Warning: Unused dummy argument '_formal_4' at (1) [-Wunused-dummy-argument] rfplot.f90:86:32: call sphcrd(v5,r,tp) 1 Warning: Unused dummy argument '_formal_5' at (1) [-Wunused-dummy-argument] rfplot.f90:86:32: call sphcrd(v5,r,tp) 1 Warning: Unused dummy argument '_formal_6' at (1) [-Wunused-dummy-argument] rfplot.f90:86:32: call sphcrd(v5,r,tp) 1 Warning: Unused dummy argument '_formal_7' at (1) [-Wunused-dummy-argument] rfplot.f90:87:37: call genrlm(lmaxo,tp,rlm) 1 Warning: Unused dummy argument '_formal_8' at (1) [-Wunused-dummy-argument] rfplot.f90:87:37: call genrlm(lmaxo,tp,rlm) 1 Warning: Unused dummy argument '_formal_9' at (1) [-Wunused-dummy-argument] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rotdmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hrmdmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c reademd.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c emdplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfhkintp.f90 rfhkintp.f90:77:0: t2=(vhpl(3)-v0(3))*dble(ngridk(3)) Warning: 'v0[2]' may be used uninitialized in this function [-Wmaybe-uninitialized] rfhkintp.f90:67:0: t2=(vhpl(1)-v0(1))*dble(ngridk(1)) Warning: 'v0[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] rfhkintp.f90:73:0: t2=(vhpl(2)-v0(2))*dble(ngridk(2)) Warning: 'v0[1]' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c emdplot3d.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c emdplot2d.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c emdplot1d.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c plotpt3d.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c plotpt2d.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genvmmtsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeevsp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sctovec.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c straingkq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ztpmm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeepsinv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c putepsinv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c torque.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ssfsmjx.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c curden.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c curdenk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c closefiles.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c curdenplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c wxcplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c nfftifc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c checkmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mtdmin.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fsmooth.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfmtlm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfmtlm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fermisurf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writesym.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c addlorbcnd.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sdelta.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c stheta.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sdelta_mp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c stheta_mp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sdelta_fd.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c stheta_fd.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sdelta_sq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c stheta_sq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sdelta_lr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c stheta_lr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mixlinear.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mixbroyden.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rlmrot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rotrflm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c radnucl.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writegeom.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c effmass.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mossbauer.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findband.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c geomplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genlmirep.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gndstate.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ssfext.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sstask.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c spiralsc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genscss.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genfspecies.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writespecies.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c massnucl.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genlofr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genrmesh.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rhocore.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c init0.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c init1.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c init2.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c init3.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c init4.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfinpc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gcd.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sortidx.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c erf.f90 erf.f90:8:0: real(8) function erf(x) Warning: 'erf' declared at (1) is also the name of an intrinsic. It can only be called via an explicit interface or if declared EXTERNAL. [-Wintrinsic-shadow] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c orthevsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c moment.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c occupy.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rschrodint.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c lopzflm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sphcover.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c delevec.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genapwfr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c polynom.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genkmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genshtmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveqnfvz.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findnjcmax.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeengy.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gridsize.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sbesseldm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findscq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writelsj.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getcfgq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c proj2d.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dielectric.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c nonlinopt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c vecplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c wfcrplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c energykncr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rhoplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveqnit.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveqnss.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rhoinit.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c maginit.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c grad2rfmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gendmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c symdmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gensdmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggamt_1.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggair_1.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggamt_sp_1.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggair_sp_1.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggamt_2a.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggair_2a.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggamt_2b.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggair_2b.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggamt_sp_2a.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggair_sp_2a.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggamt_sp_2b.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ggair_sp_2b.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genspecies.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeemd.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rhomagk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c wavefcr.f90 wavefcr.f90:123:0: if (lm2.gt.0) wfcr(i2,2)=t0*c2 Warning: 'i2' may be used uninitialized in this function [-Wmaybe-uninitialized] wavefcr.f90:124:0: i1=i1+lmmaxo Warning: 'i1' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c exxengy.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c exxengyk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveqnhf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gentau.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gentauk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gentaucr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c xc_c_tb09.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c elfplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genexpmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gradrfmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c projsbf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genpmatk.f90 genpmatk.f90:55:0: complex(8), allocatable :: gvmt(:,:),zfmt1(:,:),zfmt2(:,:,:) Warning: 'gvmt.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] genpmatk.f90:55:0: Warning: 'zfmt1.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] genpmatk.f90:55:0: Warning: 'zfmt1.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] genpmatk.f90:55:0: Warning: 'zfmt2.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] genpmatk.f90:55:0: Warning: 'zfmt2.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] genpmatk.f90:55:0: Warning: 'zfmt2.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] genpmatk.f90:55:0: Warning: 'gvmt.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c putpmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genwfsv.f90 genwfsv.f90:65:0: complex(8), allocatable :: wfmt1(:,:,:),wfmt2(:) Warning: 'wfmt1.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] genwfsv.f90:65:0: Warning: 'wfmt1.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genwfsvp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c allatoms.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potcoul.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gensfacgp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rhomag.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zgerci.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genffacgp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writelat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findkpt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fsmfield.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c checkfsm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveqnsv.f90 eveqnsv.f90:35:0: complex(8), allocatable :: wfir1(:),wfir2(:),wfgp(:,:),gwfgp(:,:) Warning: 'gwfgp.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] eveqnsv.f90:35:0: Warning: 'gwfgp.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] eveqnsv.f90:34:0: complex(8), allocatable :: gwfmt(:,:,:),gzfmt(:,:) Warning: 'gzfmt.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] eveqnsv.f90:34:0: Warning: 'gzfmt.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] eveqnsv.f90:34:0: Warning: 'gwfmt.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] eveqnsv.f90:34:0: Warning: 'gwfmt.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c brzint.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gentpmae.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genstrain.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeiad.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c symveca.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c symvec.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c nuclei.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genstress.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writestress.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c latvstep.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c putoccsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getoccsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c elnes.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potefield.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeinfo.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readinput.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hermite.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writelinen.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writesf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c wigner3j.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c wigner3jf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c wigner6j.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c clebgor.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gaunt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gauntyry.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c roteuler.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eulerrot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c reciplat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fermisurfbxsf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeeval.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readspecies.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gencore.f90 gencore.f90:41:0: real(8), allocatable :: br(:),fr(:,:) Warning: 'fr.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] gencore.f90:41:0: Warning: 'fr.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genhvec.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeforces.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c pade.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c pades.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genjlgprmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c symmetry.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findsym.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findsymcrys.f90 findsymcrys.f90:192:0: v1(:)=atposl(:,1,1)-v0(:) Warning: 'v0[0]' may be used uninitialized in this function [-Wmaybe-uninitialized] findsymcrys.f90:192:0: Warning: 'v0[1]' may be used uninitialized in this function [-Wmaybe-uninitialized] findsymcrys.f90:192:0: Warning: 'v0[2]' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findsymsite.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writekpts.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c olpistl.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c olpalo.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c olplolo.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmlaa.f90 hmlaa.f90:100:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_0' at (1) [-Wunused-dummy-argument] hmlaa.f90:100:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_1' at (1) [-Wunused-dummy-argument] hmlaa.f90:105:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_10' at (1) [-Wunused-dummy-argument] hmlaa.f90:105:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_11' at (1) [-Wunused-dummy-argument] hmlaa.f90:100:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_2' at (1) [-Wunused-dummy-argument] hmlaa.f90:100:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_3' at (1) [-Wunused-dummy-argument] hmlaa.f90:100:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_4' at (1) [-Wunused-dummy-argument] hmlaa.f90:100:37: call zaxpy(j-1,z1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_5' at (1) [-Wunused-dummy-argument] hmlaa.f90:105:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_6' at (1) [-Wunused-dummy-argument] hmlaa.f90:105:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_7' at (1) [-Wunused-dummy-argument] hmlaa.f90:105:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_8' at (1) [-Wunused-dummy-argument] hmlaa.f90:105:41: call daxpy(2*(j-1),a1,x,1,a(k+1),1) 1 Warning: Unused dummy argument '_formal_9' at (1) [-Wunused-dummy-argument] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmlalo.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writefsm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c plotpt1d.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c testcheck.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c atom.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c geomopt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c atpstep.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c bandstr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findsymlat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c putevalfv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getevalfv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mixerifc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c axangsu2.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c wfplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeefg.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gensocfr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c nesting.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dos.f90 dos.f90:342:0: lm,elm(lm,ias) Warning: 'elm.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] dos.f90:342:0: Warning: 'elm.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writedos.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c putevecfv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getevecfv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writefermi.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readfermi.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfmtctof.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rotrfmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfmtftoc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfinterp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ylmrot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ylmroty.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveqnfvr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findprimcell.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c energy.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writechg.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c plot1d.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c plot2d.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c plot3d.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findswidth.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mae.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writestate.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readstate.f90 readstate.f90:327:70: call rfinterp(nrcmt_(is),rcmt_(:,is),fi,nrcmt(is),rcmt(:,is),fo) 1 Warning: Unused dummy argument '_formal_0' at (1) [-Wunused-dummy-argument] readstate.f90:327:70: call rfinterp(nrcmt_(is),rcmt_(:,is),fi,nrcmt(is),rcmt(:,is),fo) 1 Warning: Unused dummy argument '_formal_1' at (1) [-Wunused-dummy-argument] readstate.f90:331:69: call rfmtpack(.true.,nrcmt(is),nrcmti(is),rfmt,rvfcmt(:,ias,idm)) 1 Warning: Unused dummy argument '_formal_10' at (1) [-Wunused-dummy-argument] readstate.f90:303:66: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_11' at (1) [-Wunused-dummy-argument] readstate.f90:303:66: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_12' at (1) [-Wunused-dummy-argument] readstate.f90:303:66: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_13' at (1) [-Wunused-dummy-argument] readstate.f90:303:66: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_14' at (1) [-Wunused-dummy-argument] readstate.f90:303:66: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_15' at (1) [-Wunused-dummy-argument] readstate.f90:303:66: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_16' at (1) [-Wunused-dummy-argument] readstate.f90:307:66: call rfmtpack(.true.,nrmt(is),nrmti(is),rfmt,rvfmt(:,ias,idm)) 1 Warning: Unused dummy argument '_formal_17' at (1) [-Wunused-dummy-argument] readstate.f90:307:66: call rfmtpack(.true.,nrmt(is),nrmti(is),rfmt,rvfmt(:,ias,idm)) 1 Warning: Unused dummy argument '_formal_18' at (1) [-Wunused-dummy-argument] readstate.f90:307:66: call rfmtpack(.true.,nrmt(is),nrmti(is),rfmt,rvfmt(:,ias,idm)) 1 Warning: Unused dummy argument '_formal_19' at (1) [-Wunused-dummy-argument] readstate.f90:327:70: call rfinterp(nrcmt_(is),rcmt_(:,is),fi,nrcmt(is),rcmt(:,is),fo) 1 Warning: Unused dummy argument '_formal_2' at (1) [-Wunused-dummy-argument] readstate.f90:307:66: call rfmtpack(.true.,nrmt(is),nrmti(is),rfmt,rvfmt(:,ias,idm)) 1 Warning: Unused dummy argument '_formal_20' at (1) [-Wunused-dummy-argument] readstate.f90:307:66: call rfmtpack(.true.,nrmt(is),nrmti(is),rfmt,rvfmt(:,ias,idm)) 1 Warning: Unused dummy argument '_formal_21' at (1) [-Wunused-dummy-argument] readstate.f90:279:64: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_22' at (1) [-Wunused-dummy-argument] readstate.f90:279:64: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_23' at (1) [-Wunused-dummy-argument] readstate.f90:279:64: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_24' at (1) [-Wunused-dummy-argument] readstate.f90:279:64: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_25' at (1) [-Wunused-dummy-argument] readstate.f90:279:64: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_26' at (1) [-Wunused-dummy-argument] readstate.f90:279:64: call rfinterp(nrmt_(is),rsp_(:,is),fi,nrmt(is),rsp(:,is),fo) 1 Warning: Unused dummy argument '_formal_27' at (1) [-Wunused-dummy-argument] readstate.f90:284:60: call rfmtpack(.true.,nrmt(is),nrmti(is),rfmt,rfmtp(:,ias)) 1 Warning: Unused dummy argument '_formal_28' at (1) [-Wunused-dummy-argument] readstate.f90:284:60: call rfmtpack(.true.,nrmt(is),nrmti(is),rfmt,rfmtp(:,ias)) 1 Warning: Unused dummy argument '_formal_29' at (1) [-Wunused-dummy-argument] readstate.f90:327:70: call rfinterp(nrcmt_(is),rcmt_(:,is),fi,nrcmt(is),rcmt(:,is),fo) 1 Warning: Unused dummy argument '_formal_3' at (1) [-Wunused-dummy-argument] readstate.f90:284:60: call rfmtpack(.true.,nrmt(is),nrmti(is),rfmt,rfmtp(:,ias)) 1 Warning: Unused dummy argument '_formal_30' at (1) [-Wunused-dummy-argument] readstate.f90:284:60: call rfmtpack(.true.,nrmt(is),nrmti(is),rfmt,rfmtp(:,ias)) 1 Warning: Unused dummy argument '_formal_31' at (1) [-Wunused-dummy-argument] readstate.f90:284:60: call rfmtpack(.true.,nrmt(is),nrmti(is),rfmt,rfmtp(:,ias)) 1 Warning: Unused dummy argument '_formal_32' at (1) [-Wunused-dummy-argument] readstate.f90:327:70: call rfinterp(nrcmt_(is),rcmt_(:,is),fi,nrcmt(is),rcmt(:,is),fo) 1 Warning: Unused dummy argument '_formal_4' at (1) [-Wunused-dummy-argument] readstate.f90:327:70: call rfinterp(nrcmt_(is),rcmt_(:,is),fi,nrcmt(is),rcmt(:,is),fo) 1 Warning: Unused dummy argument '_formal_5' at (1) [-Wunused-dummy-argument] readstate.f90:331:69: call rfmtpack(.true.,nrcmt(is),nrcmti(is),rfmt,rvfcmt(:,ias,idm)) 1 Warning: Unused dummy argument '_formal_6' at (1) [-Wunused-dummy-argument] readstate.f90:331:69: call rfmtpack(.true.,nrcmt(is),nrcmti(is),rfmt,rvfcmt(:,ias,idm)) 1 Warning: Unused dummy argument '_formal_7' at (1) [-Wunused-dummy-argument] readstate.f90:331:69: call rfmtpack(.true.,nrcmt(is),nrcmti(is),rfmt,rvfcmt(:,ias,idm)) 1 Warning: Unused dummy argument '_formal_8' at (1) [-Wunused-dummy-argument] readstate.f90:331:69: call rfmtpack(.true.,nrcmt(is),nrcmti(is),rfmt,rvfcmt(:,ias,idm)) 1 Warning: Unused dummy argument '_formal_9' at (1) [-Wunused-dummy-argument] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rotaxang.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c axangrot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c i3minv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c i3mdet.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c i3mtv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3mv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3mtv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3cross.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3minv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3mdet.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3mm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3mtm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3mmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zflmconj.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rotzflm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c symmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3vo.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writestrain.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rfint0.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c phdelete.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gendcfun.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dmatch.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gendvsig.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gradrhomt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dpotxc.f90 dpotxc.f90:16:0: complex(8), allocatable :: dvmt(:),dbmt(:,:),zfmt(:) Warning: 'dbmt.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] dpotxc.f90:16:0: Warning: 'dbmt.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dolpalo.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dhmlalo.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dolpaa.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dhmllolo.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dwavefmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c phonon.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dpotks.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dhmlaa.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dhmlrad.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gendwfsv.f90 gendwfsv.f90:32:0: complex(8), allocatable :: wfmt1(:,:),wfmt2(:),dwfmt1(:,:) Warning: 'wfmt1.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] gendwfsv.f90:32:0: Warning: 'dwfmt1.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c drhomagk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c drhomagsh.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmlaaq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmlaloq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c olpaaq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c olpaloq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gengvsmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dpotcoul.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dforcek.f90 dforcek.f90:27:0: complex(8), allocatable :: evecsv(:,:),devecsv(:,:) Warning: 'evecsv.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] dforcek.f90:27:0: Warning: 'evecsv.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] dforcek.f90:27:0: Warning: 'devecsv.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] dforcek.f90:27:0: Warning: 'devecsv.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gengkqvec.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gengqvec.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genmcph.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c deveqnfv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dhmlistl.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dolpistl.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c phmixpack.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c putdevecfv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getdevecfv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c doccupy.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c putdevecsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getdevecsv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c phononsc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dyntask.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genscph.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c phdisp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readdyn.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dynqtor.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dynrtoq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dynsymapp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dynsym.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dynev.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dynevs.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c phdos.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sumrule.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writephn.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c phfext.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writegamma.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readgamma.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c phlwidth.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c alpha2f.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writelambda.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c phscdelete.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ephcouple.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genephmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eliashberg.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c phscdvs.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writedvs.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readdvs.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readalpha2f.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mcmillan.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dforce.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gendsocfr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c hmlbdg.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveqnbdg.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c scdft.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genachi.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c bdginv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c achiinit.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genidxbdg.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c xc_pzca.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c xc_pwca.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c xc_pbe.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c xc_am05.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c xc_xalpha.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c xc_wc06.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c x_wc06.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c x_pbe.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c c_pbe.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c c_pbe_gcor.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c xc_vbh.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fxc_pwca.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gendmatmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genveedu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genvmatmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writedftu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readalphadu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fyukawa.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fyukawa0.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genfdufr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c energyfdu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeefdu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zbessela.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zbesselb.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readdmatmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genfdu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findlambdadu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readfdu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writetmdu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writetm2du.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writetm3du.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dmtotm2.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dmtotm3.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c tm2todm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c tm3todm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c pottm2.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c pottm3.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c tm2pol.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c tm3pol.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gendmftm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ftmfield.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeftm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmft.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmdkdc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmminc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmvaryc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmdedc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmenergy.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmengyxc.f90 rdmengyxc.f90:73:0: engyx=engyx-t2*vclijji(ist2,ist1,ik2) Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmwritededn.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmwriteengy.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmminn.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmvaryn.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmdedn.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmdexcdn.f90 rdmdexcdn.f90:77:0: dedn(ist2,ik2)=dedn(ist2,ik2)+t2*vclijji(ist2,ist1,ik2) Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genvclijji.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genvclijjk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getvclijji.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getvclijjk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writevclijji.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writevclijjk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmdexcdc.f90 rdmdexcdc.f90:80:0: vclijjk(ist1,ist3,ist4,ik2) Warning: 't2' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmdtsdn.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmentropy.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rdmeval.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c putgwsefm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getgwsefm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genwgw.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gwchgk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gwsefmk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dysonr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gwspecf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writegwsf.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c acgwse.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c minf_nm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fmin_nm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c polefit.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c acpole.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c zfpole.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gwbandstr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gtwsum.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gwscrho.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gwefermi.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gwrhomag.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gwdmatk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c ksinvert.f90 ksinvert.f90:65:52: call daxpy(np,tauksi,rfmt(:,ias),1,vxcmt(:,ias),1) 1 Warning: Unused dummy argument '_formal_0' at (1) [-Wunused-dummy-argument] ksinvert.f90:65:52: call daxpy(np,tauksi,rfmt(:,ias),1,vxcmt(:,ias),1) 1 Warning: Unused dummy argument '_formal_1' at (1) [-Wunused-dummy-argument] ksinvert.f90:65:52: call daxpy(np,tauksi,rfmt(:,ias),1,vxcmt(:,ias),1) 1 Warning: Unused dummy argument '_formal_2' at (1) [-Wunused-dummy-argument] ksinvert.f90:65:52: call daxpy(np,tauksi,rfmt(:,ias),1,vxcmt(:,ias),1) 1 Warning: Unused dummy argument '_formal_3' at (1) [-Wunused-dummy-argument] ksinvert.f90:65:52: call daxpy(np,tauksi,rfmt(:,ias),1,vxcmt(:,ias),1) 1 Warning: Unused dummy argument '_formal_4' at (1) [-Wunused-dummy-argument] ksinvert.f90:65:52: call daxpy(np,tauksi,rfmt(:,ias),1,vxcmt(:,ias),1) 1 Warning: Unused dummy argument '_formal_5' at (1) [-Wunused-dummy-argument] ksinvert.f90:69:33: resoep=rfinp(rfmt,rfir,rfmt,rfir) 1 Warning: Unused dummy argument '_formal_6' at (1) [-Wunused-dummy-argument] ksinvert.f90:69:33: resoep=rfinp(rfmt,rfir,rfmt,rfir) 1 Warning: Unused dummy argument '_formal_7' at (1) [-Wunused-dummy-argument] ksinvert.f90:69:33: resoep=rfinp(rfmt,rfir,rfmt,rfir) 1 Warning: Unused dummy argument '_formal_8' at (1) [-Wunused-dummy-argument] ksinvert.f90:69:33: resoep=rfinp(rfmt,rfir,rfmt,rfir) 1 Warning: Unused dummy argument '_formal_9' at (1) [-Wunused-dummy-argument] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gwlocal.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gwsefm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeigw.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gwdmat.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c tddft.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potkst.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c timestep.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genhmlt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c tddftlr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genvfxc.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genfxcr.f90 genfxcr.f90:18:0: real(8), allocatable :: rho(:),rhoup(:),rhodn(:),mag(:,:) Warning: 'mag.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] genfxcr.f90:18:0: Warning: 'mag.offset' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c tdtemp.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writetimes.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readtimes.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genspfxcr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genvfxcg.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gentimes.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c tdbackup.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c tddftsplr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genspfxcg.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genafieldt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readafieldt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writetddft.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeafpdt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writetddos.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c dielectric_tdrt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readcurrent.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writechgu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeevalu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genkpakq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c initulr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveqnulr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genzvmatk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genzvbmatk.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c occupyulr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeinfou.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writemomrmt.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writeengyu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c momentu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gndstulr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c pksuinit.f90 pksuinit.f90:24:12: vclru(ir)=rndulr*cmplx(randomu()-0.5d0,randomu()-0.5d0,8) 1 Warning: Possible change of value in conversion from COMPLEX(8) to REAL(8) at (1) [-Wconversion] pksuinit.f90:40:18: bfcru(ir,idm)=rndulr*cmplx(randomu()-0.5d0,randomu()-0.5d0,8) 1 Warning: Possible change of value in conversion from COMPLEX(8) to REAL(8) at (1) [-Wconversion] pksuinit.f90:44:26: bfcmtru(ir,ias,idm)=rndulr*cmplx(randomu()-0.5d0,randomu()-0.5d0,8) 1 Warning: Possible change of value in conversion from COMPLEX(8) to REAL(8) at (1) [-Wconversion] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potxculr.f90 potxculr.f90:20:0: real(8), allocatable :: vxcmt_(:,:),bxcmt_(:,:,:) Warning: 'bxcmt_.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxculr.f90:20:0: Warning: 'bxcmt_.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] potxculr.f90:20:0: Warning: 'bxcmt_.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxculr.f90:20:0: Warning: 'bxcmt_.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] potxculr.f90:19:0: real(8), allocatable :: rhomt_(:,:),magmt_(:,:,:) Warning: 'magmt_.dim[2].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxculr.f90:19:0: Warning: 'magmt_.dim[2].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] potxculr.f90:19:0: Warning: 'magmt_.dim[1].lbound' may be used uninitialized in this function [-Wmaybe-uninitialized] potxculr.f90:19:0: Warning: 'magmt_.dim[1].stride' may be used uninitialized in this function [-Wmaybe-uninitialized] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potksulr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c genhmlu.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rhomaguk.f90 rhomaguk.f90:196:68: call zaxpy(npcmt(is),za,wfmt1(:,ias,ispn),1,wfmt2(:,ias,ispn),1) 1 Warning: Unused dummy argument '_formal_0' at (1) [-Wunused-dummy-argument] rhomaguk.f90:196:68: call zaxpy(npcmt(is),za,wfmt1(:,ias,ispn),1,wfmt2(:,ias,ispn),1) 1 Warning: Unused dummy argument '_formal_1' at (1) [-Wunused-dummy-argument] rhomaguk.f90:196:68: call zaxpy(npcmt(is),za,wfmt1(:,ias,ispn),1,wfmt2(:,ias,ispn),1) 1 Warning: Unused dummy argument '_formal_2' at (1) [-Wunused-dummy-argument] rhomaguk.f90:196:68: call zaxpy(npcmt(is),za,wfmt1(:,ias,ispn),1,wfmt2(:,ias,ispn),1) 1 Warning: Unused dummy argument '_formal_3' at (1) [-Wunused-dummy-argument] rhomaguk.f90:196:68: call zaxpy(npcmt(is),za,wfmt1(:,ias,ispn),1,wfmt2(:,ias,ispn),1) 1 Warning: Unused dummy argument '_formal_4' at (1) [-Wunused-dummy-argument] rhomaguk.f90:196:68: call zaxpy(npcmt(is),za,wfmt1(:,ias,ispn),1,wfmt2(:,ias,ispn),1) 1 Warning: Unused dummy argument '_formal_5' at (1) [-Wunused-dummy-argument] mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c rhomagq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c mixpacku.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c potclulr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writestulr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readstulr.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -o elk modmain.o modmpi.o libxc_funcs.o libxc.o libxcifc.o modxcifc.o modfxcifc.o moddftu.o modrdm.o modphonon.o modscdft.o modtest.o modrandom.o modstore.o modpw.o modvars.o modtddft.o modgw.o modulr.o modjx.o modomp.o mkl_stub.o mkl_init.o oblas_stub.o oblas_init.o blis_stub.o blis_init.o zfftifc_fftw.o elk.o zftzf.o wavefmt.o eveqnz.o mixadapt.o genidxlo.o findqpt.o linengy.o fintgt.o genevfsv.o eveqnfv.o hmlfv.o olpfv.o rhomagsh.o rtozfmt.o ztorfmt.o vecfbz.o potnucl.o potks.o zfmtint.o putevalsv.o getevalsv.o rdiracint.o rdirac.o mixpack.o gengclg.o eveqn.o genvmat.o rfint.o rfpack.o genbs.o genws.o writeqpts.o rfmtctof.o genapwlofr.o olpaa.o gradzfmt.o spline.o zfcmtinp.o symrfir.o sphcrd.o energynn.o gengkvec.o r3frac.o timesec.o rzfmtinp.o hmlrad.o olprad.o splintp.o splint.o gengvc.o rfmtinp.o zftwfir.o zfinp.o rndevsv.o rfinp.o z2mm.o z2mctm.o z2mmct.o rfcopy.o genjlgpr.o sbessel.o findngkmax.o genylmg.o gengclgq.o genzrho.o zbsht.o zfsht.o rtozflm.o rbsht.o rfsht.o genylm.o genrlm.o potxc.o potxcmt.o potxcir.o putkmat.o getkmat.o charge.o chargemt.o factnm.o factr.o rfmtftoc.o gencfun.o genzvclmt.o rzfinp.o rfmtpack.o zfmtpack.o genvmatk.o genvbmatk.o hmllolo.o ztorflm.o zfmtinp.o rhonorm.o gradzf.o gradrf.o zpotclmt.o zpotcoul.o zfmtconj.o match.o gencfrc.o hmlistl.o gengclq.o writegclq.o genppts.o rfmtsm.o rfirsm.o putevecsv.o getevecsv.o genpmat.o genvsig.o fderiv.o gengvec.o zfpack.o writepmat.o getpmat.o gengqrf.o moke.o sfacinit.o sfacrho.o sfacmag.o gradwf2.o gradwfcr2.o force.o forcek.o symrf.o symrfmt.o symrvfir.o symrvf.o symrvfmt.o initoep.o oepmain.o oepresk.o oepvcl.o oepvclk.o genvchi0.o genspchi0.o epsinv.o dbxcplot.o vclcore.o genzrm.o genzfrm.o zftrf.o writehmlbse.o hmlxbse.o hmlxbsek.o hmldbse.o hmldbsek.o dielectric_bse.o genidxbse.o writeevbse.o hartfock.o hflocal.o genwfpw.o writewfpw.o getwfpw.o genexpmat.o writeexpmat.o rvfcross.o rfplot.o rotdmat.o hrmdmat.o reademd.o emdplot.o rfhkintp.o emdplot3d.o emdplot2d.o emdplot1d.o plotpt3d.o plotpt2d.o genvmmtsv.o writeevsp.o sctovec.o straingkq.o ztpmm.o writeepsinv.o putepsinv.o torque.o ssfsmjx.o curden.o curdenk.o closefiles.o curdenplot.o wxcplot.o nfftifc.o checkmt.o mtdmin.o fsmooth.o rfmtlm.o zfmtlm.o fermisurf.o writesym.o addlorbcnd.o sdelta.o stheta.o sdelta_mp.o stheta_mp.o sdelta_fd.o stheta_fd.o sdelta_sq.o stheta_sq.o sdelta_lr.o stheta_lr.o mixlinear.o mixbroyden.o rlmrot.o rotrflm.o radnucl.o writegeom.o effmass.o mossbauer.o findband.o geomplot.o genlmirep.o gndstate.o ssfext.o sstask.o spiralsc.o genscss.o genfspecies.o writespecies.o massnucl.o genlofr.o genrmesh.o rhocore.o init0.o init1.o init2.o init3.o init4.o rfinpc.o gcd.o sortidx.o erf.o orthevsv.o moment.o occupy.o rschrodint.o lopzflm.o sphcover.o delevec.o genapwfr.o polynom.o genkmat.o genshtmat.o eveqnfvz.o findnjcmax.o writeengy.o gridsize.o sbesseldm.o findscq.o writelsj.o getcfgq.o proj2d.o dielectric.o nonlinopt.o vecplot.o wfcrplot.o energykncr.o rhoplot.o eveqnit.o eveqnss.o rhoinit.o maginit.o grad2rfmt.o gendmat.o symdmat.o gensdmat.o ggamt_1.o ggair_1.o ggamt_sp_1.o ggair_sp_1.o ggamt_2a.o ggair_2a.o ggamt_2b.o ggair_2b.o ggamt_sp_2a.o ggair_sp_2a.o ggamt_sp_2b.o ggair_sp_2b.o genspecies.o writeemd.o rhomagk.o wavefcr.o exxengy.o exxengyk.o eveqnhf.o gentau.o gentauk.o gentaucr.o xc_c_tb09.o elfplot.o genexpmt.o gradrfmt.o projsbf.o genpmatk.o putpmat.o genwfsv.o genwfsvp.o allatoms.o potcoul.o gensfacgp.o rhomag.o zgerci.o genffacgp.o writelat.o findkpt.o fsmfield.o checkfsm.o eveqnsv.o brzint.o gentpmae.o genstrain.o writeiad.o symveca.o symvec.o nuclei.o genstress.o writestress.o latvstep.o putoccsv.o getoccsv.o elnes.o potefield.o writeinfo.o readinput.o hermite.o writelinen.o writesf.o wigner3j.o wigner3jf.o wigner6j.o clebgor.o gaunt.o gauntyry.o roteuler.o eulerrot.o reciplat.o fermisurfbxsf.o writeeval.o readspecies.o gencore.o genhvec.o writeforces.o pade.o pades.o genjlgprmt.o symmetry.o findsym.o findsymcrys.o findsymsite.o writekpts.o olpistl.o olpalo.o olplolo.o hmlaa.o hmlalo.o writefsm.o plotpt1d.o testcheck.o atom.o geomopt.o atpstep.o bandstr.o findsymlat.o putevalfv.o getevalfv.o mixerifc.o axangsu2.o wfplot.o writeefg.o gensocfr.o nesting.o dos.o writedos.o putevecfv.o getevecfv.o writefermi.o readfermi.o zfmtctof.o rotrfmt.o zfmtftoc.o rfinterp.o ylmrot.o ylmroty.o eveqnfvr.o findprimcell.o energy.o writechg.o potplot.o plot1d.o plot2d.o plot3d.o findswidth.o mae.o writestate.o readstate.o rotaxang.o axangrot.o i3minv.o i3mdet.o i3mtv.o r3mv.o r3mtv.o r3cross.o r3minv.o r3mdet.o r3mm.o r3mtm.o r3mmt.o zflmconj.o rotzflm.o symmat.o r3vo.o writestrain.o rfint0.o phdelete.o gendcfun.o dmatch.o gendvsig.o gradrhomt.o dpotxc.o dolpalo.o dhmlalo.o dolpaa.o dhmllolo.o dwavefmt.o phonon.o dpotks.o dhmlaa.o dhmlrad.o gendwfsv.o drhomagk.o drhomagsh.o hmlaaq.o hmlaloq.o olpaaq.o olpaloq.o gengvsmt.o dpotcoul.o dforcek.o gengkqvec.o gengqvec.o genmcph.o deveqnfv.o dhmlistl.o dolpistl.o phmixpack.o putdevecfv.o getdevecfv.o doccupy.o putdevecsv.o getdevecsv.o phononsc.o dyntask.o genscph.o phdisp.o readdyn.o dynqtor.o dynrtoq.o dynsymapp.o dynsym.o dynev.o dynevs.o phdos.o sumrule.o writephn.o phfext.o writegamma.o readgamma.o phlwidth.o alpha2f.o writelambda.o phscdelete.o ephcouple.o genephmat.o eliashberg.o phscdvs.o writedvs.o readdvs.o readalpha2f.o mcmillan.o dforce.o gendsocfr.o hmlbdg.o eveqnbdg.o scdft.o genachi.o bdginv.o achiinit.o genidxbdg.o xc_pzca.o xc_pwca.o xc_pbe.o xc_am05.o xc_xalpha.o xc_wc06.o x_wc06.o x_pbe.o c_pbe.o c_pbe_gcor.o xc_vbh.o fxc_pwca.o gendmatmt.o genveedu.o genvmatmt.o writedftu.o readalphadu.o fyukawa.o fyukawa0.o genfdufr.o energyfdu.o writeefdu.o zbessela.o zbesselb.o readdmatmt.o genfdu.o findlambdadu.o readfdu.o writetmdu.o writetm2du.o writetm3du.o dmtotm2.o dmtotm3.o tm2todm.o tm3todm.o pottm2.o pottm3.o tm2pol.o tm3pol.o gendmftm.o ftmfield.o writeftm.o rdmft.o rdmdkdc.o rdmminc.o rdmvaryc.o rdmdedc.o rdmenergy.o rdmengyxc.o rdmwritededn.o rdmwriteengy.o rdmminn.o rdmvaryn.o rdmdedn.o rdmdexcdn.o genvclijji.o genvclijjk.o getvclijji.o getvclijjk.o writevclijji.o writevclijjk.o rdmdexcdc.o rdmdtsdn.o rdmentropy.o rdmeval.o putgwsefm.o getgwsefm.o genwgw.o gwchgk.o gwsefmk.o dysonr.o gwspecf.o writegwsf.o acgwse.o minf_nm.o fmin_nm.o polefit.o acpole.o zfpole.o gwbandstr.o gtwsum.o gwscrho.o gwefermi.o gwrhomag.o gwdmatk.o ksinvert.o gwlocal.o gwsefm.o writeigw.o gwdmat.o tddft.o potkst.o timestep.o genhmlt.o tddftlr.o genvfxc.o genfxcr.o tdtemp.o writetimes.o readtimes.o genspfxcr.o genvfxcg.o gentimes.o tdbackup.o tddftsplr.o genspfxcg.o genafieldt.o readafieldt.o writetddft.o writeafpdt.o writetddos.o dielectric_tdrt.o readcurrent.o writechgu.o writeevalu.o genkpakq.o initulr.o eveqnulr.o genzvmatk.o genzvbmatk.o occupyulr.o writeinfou.o writemomrmt.o writeengyu.o momentu.o gndstulr.o pksuinit.o potxculr.o potksulr.o genhmlu.o rhomaguk.o rhomagq.o mixpacku.o potclulr.o writestulr.o readstulr.o -llapack -lblas `pkg-config --cflags --libs fftw3` `pkg-config --cflags --libs libxc` -lxcf90 \ make[3]: Leaving directory '/build/elkcode-5.4.24/src' cd src/eos; make make[3]: Entering directory '/build/elkcode-5.4.24/src/eos' mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modmain.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eos.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c eveos.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c pveos.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readinput.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c getedata.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fitdata.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c output.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c minf_nm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c fmin_nm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -o eos modmain.o eos.o eveos.o pveos.o readinput.o getedata.o fitdata.o output.o minf_nm.o fmin_nm.o make[3]: Leaving directory '/build/elkcode-5.4.24/src/eos' cd src/spacegroup; make make[3]: Entering directory '/build/elkcode-5.4.24/src/spacegroup' mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c modmain.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c main.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c readinput.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gencrystal.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c sgsymb.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c seitzgen.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c gengroup.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c seitzeq.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c seitzmul.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c writegeom.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c geomplot.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c findprimcell.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3frac.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3mv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3cross.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3minv.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -c r3mm.f90 mpif90 `dpkg-buildflags --get FFLAGS` `dpkg-buildflags --get CPPFLAGS` -Wall -ffast-math -funroll-loops -fopenmp `dpkg-buildflags --get LDFLAGS` -o spacegroup modmain.o main.o readinput.o gencrystal.o sgsymb.o seitzgen.o gengroup.o seitzeq.o seitzmul.o writegeom.o geomplot.o findprimcell.o r3frac.o r3mv.o r3cross.o r3minv.o r3mm.o make[3]: Leaving directory '/build/elkcode-5.4.24/src/spacegroup' make[2]: Leaving directory '/build/elkcode-5.4.24' (cd src; /usr/bin/make doc) make[2]: Entering directory '/build/elkcode-5.4.24/src' rm -f elk.aux elk.bbl elk.blg elk.log elk.pdf elk.tex elk.toc elk.lst ls modmain.f90 modmpi.f90 libxc_funcs.f90 libxc.f90 libxcifc.f90 modxcifc.f90 modfxcifc.f90 moddftu.f90 modrdm.f90 modphonon.f90 modscdft.f90 modtest.f90 modrandom.f90 modstore.f90 modpw.f90 modvars.f90 modtddft.f90 modgw.f90 modulr.f90 modjx.f90 modomp.f90 mkl_stub.f90 mkl_init.f90 oblas_stub.f90 oblas_init.f90 blis_stub.f90 blis_init.f90 zftzf.f90 wavefmt.f90 eveqnz.f90 mixadapt.f90 genidxlo.f90 findqpt.f90 linengy.f90 fintgt.f90 genevfsv.f90 eveqnfv.f90 hmlfv.f90 olpfv.f90 rhomagsh.f90 rtozfmt.f90 ztorfmt.f90 vecfbz.f90 potnucl.f90 potks.f90 zfmtint.f90 putevalsv.f90 getevalsv.f90 rdiracint.f90 rdirac.f90 mixpack.f90 gengclg.f90 eveqn.f90 genvmat.f90 rfint.f90 rfpack.f90 genbs.f90 genws.f90 writeqpts.f90 rfmtctof.f90 genapwlofr.f90 olpaa.f90 gradzfmt.f90 spline.f90 zfcmtinp.f90 symrfir.f90 sphcrd.f90 energynn.f90 gengkvec.f90 r3frac.f90 timesec.f90 rzfmtinp.f90 hmlrad.f90 olprad.f90 splintp.f90 splint.f90 gengvc.f90 rfmtinp.f90 zftwfir.f90 zfinp.f90 rndevsv.f90 rfinp.f90 z2mm.f90 z2mctm.f90 z2mmct.f90 rfcopy.f90 genjlgpr.f90 sbessel.f90 findngkmax.f90 genylmg.f90 gengclgq.f90 genzrho.f90 zbsht.f90 zfsht.f90 rtozflm.f90 rbsht.f90 rfsht.f90 genylm.f90 genrlm.f90 potxc.f90 potxcmt.f90 potxcir.f90 putkmat.f90 getkmat.f90 charge.f90 chargemt.f90 factnm.f90 factr.f90 rfmtftoc.f90 gencfun.f90 genzvclmt.f90 rzfinp.f90 rfmtpack.f90 zfmtpack.f90 genvmatk.f90 genvbmatk.f90 hmllolo.f90 ztorflm.f90 zfmtinp.f90 rhonorm.f90 gradzf.f90 gradrf.f90 zpotclmt.f90 zpotcoul.f90 zfmtconj.f90 match.f90 gencfrc.f90 hmlistl.f90 gengclq.f90 writegclq.f90 genppts.f90 rfmtsm.f90 rfirsm.f90 putevecsv.f90 getevecsv.f90 genpmat.f90 genvsig.f90 fderiv.f90 gengvec.f90 zfpack.f90 writepmat.f90 getpmat.f90 gengqrf.f90 moke.f90 sfacinit.f90 sfacrho.f90 sfacmag.f90 gradwf2.f90 gradwfcr2.f90 force.f90 forcek.f90 symrf.f90 symrfmt.f90 symrvfir.f90 symrvf.f90 symrvfmt.f90 initoep.f90 oepmain.f90 oepresk.f90 oepvcl.f90 oepvclk.f90 genvchi0.f90 genspchi0.f90 epsinv.f90 dbxcplot.f90 vclcore.f90 genzrm.f90 genzfrm.f90 zftrf.f90 writehmlbse.f90 hmlxbse.f90 hmlxbsek.f90 hmldbse.f90 hmldbsek.f90 dielectric_bse.f90 genidxbse.f90 writeevbse.f90 hartfock.f90 hflocal.f90 genwfpw.f90 writewfpw.f90 getwfpw.f90 genexpmat.f90 writeexpmat.f90 rvfcross.f90 rfplot.f90 rotdmat.f90 hrmdmat.f90 reademd.f90 emdplot.f90 rfhkintp.f90 emdplot3d.f90 emdplot2d.f90 emdplot1d.f90 plotpt3d.f90 plotpt2d.f90 genvmmtsv.f90 writeevsp.f90 sctovec.f90 straingkq.f90 ztpmm.f90 writeepsinv.f90 putepsinv.f90 torque.f90 ssfsmjx.f90 curden.f90 curdenk.f90 closefiles.f90 curdenplot.f90 wxcplot.f90 nfftifc.f90 checkmt.f90 mtdmin.f90 fsmooth.f90 rfmtlm.f90 zfmtlm.f90 fermisurf.f90 writesym.f90 addlorbcnd.f90 sdelta.f90 stheta.f90 sdelta_mp.f90 stheta_mp.f90 sdelta_fd.f90 stheta_fd.f90 sdelta_sq.f90 stheta_sq.f90 sdelta_lr.f90 stheta_lr.f90 mixlinear.f90 mixbroyden.f90 rlmrot.f90 rotrflm.f90 radnucl.f90 writegeom.f90 effmass.f90 mossbauer.f90 findband.f90 geomplot.f90 genlmirep.f90 gndstate.f90 ssfext.f90 sstask.f90 spiralsc.f90 genscss.f90 genfspecies.f90 writespecies.f90 massnucl.f90 genlofr.f90 genrmesh.f90 rhocore.f90 init0.f90 init1.f90 init2.f90 init3.f90 init4.f90 rfinpc.f90 gcd.f90 sortidx.f90 erf.f90 orthevsv.f90 moment.f90 occupy.f90 rschrodint.f90 lopzflm.f90 sphcover.f90 delevec.f90 genapwfr.f90 polynom.f90 genkmat.f90 genshtmat.f90 eveqnfvz.f90 findnjcmax.f90 writeengy.f90 gridsize.f90 sbesseldm.f90 findscq.f90 writelsj.f90 getcfgq.f90 proj2d.f90 dielectric.f90 nonlinopt.f90 vecplot.f90 wfcrplot.f90 energykncr.f90 rhoplot.f90 eveqnit.f90 eveqnss.f90 rhoinit.f90 maginit.f90 grad2rfmt.f90 gendmat.f90 symdmat.f90 gensdmat.f90 ggamt_1.f90 ggair_1.f90 ggamt_sp_1.f90 ggair_sp_1.f90 ggamt_2a.f90 ggair_2a.f90 ggamt_2b.f90 ggair_2b.f90 ggamt_sp_2a.f90 ggair_sp_2a.f90 ggamt_sp_2b.f90 ggair_sp_2b.f90 genspecies.f90 writeemd.f90 rhomagk.f90 wavefcr.f90 exxengy.f90 exxengyk.f90 eveqnhf.f90 gentau.f90 gentauk.f90 gentaucr.f90 xc_c_tb09.f90 elfplot.f90 genexpmt.f90 gradrfmt.f90 projsbf.f90 genpmatk.f90 putpmat.f90 genwfsv.f90 genwfsvp.f90 allatoms.f90 potcoul.f90 gensfacgp.f90 rhomag.f90 zgerci.f90 genffacgp.f90 writelat.f90 findkpt.f90 fsmfield.f90 checkfsm.f90 eveqnsv.f90 brzint.f90 gentpmae.f90 genstrain.f90 writeiad.f90 symveca.f90 symvec.f90 nuclei.f90 genstress.f90 writestress.f90 latvstep.f90 putoccsv.f90 getoccsv.f90 elnes.f90 potefield.f90 writeinfo.f90 readinput.f90 hermite.f90 writelinen.f90 writesf.f90 wigner3j.f90 wigner3jf.f90 wigner6j.f90 clebgor.f90 gaunt.f90 gauntyry.f90 roteuler.f90 eulerrot.f90 reciplat.f90 fermisurfbxsf.f90 writeeval.f90 readspecies.f90 gencore.f90 genhvec.f90 writeforces.f90 pade.f90 pades.f90 genjlgprmt.f90 symmetry.f90 findsym.f90 findsymcrys.f90 findsymsite.f90 writekpts.f90 olpistl.f90 olpalo.f90 olplolo.f90 hmlaa.f90 hmlalo.f90 writefsm.f90 plotpt1d.f90 testcheck.f90 atom.f90 geomopt.f90 atpstep.f90 bandstr.f90 findsymlat.f90 putevalfv.f90 getevalfv.f90 mixerifc.f90 axangsu2.f90 wfplot.f90 writeefg.f90 gensocfr.f90 nesting.f90 dos.f90 writedos.f90 putevecfv.f90 getevecfv.f90 writefermi.f90 readfermi.f90 zfmtctof.f90 rotrfmt.f90 zfmtftoc.f90 rfinterp.f90 ylmrot.f90 ylmroty.f90 eveqnfvr.f90 findprimcell.f90 energy.f90 writechg.f90 potplot.f90 plot1d.f90 plot2d.f90 plot3d.f90 findswidth.f90 mae.f90 writestate.f90 readstate.f90 rotaxang.f90 axangrot.f90 i3minv.f90 i3mdet.f90 i3mtv.f90 r3mv.f90 r3mtv.f90 r3cross.f90 r3minv.f90 r3mdet.f90 r3mm.f90 r3mtm.f90 r3mmt.f90 zflmconj.f90 rotzflm.f90 symmat.f90 r3vo.f90 writestrain.f90 rfint0.f90 xc_pzca.f90 xc_pwca.f90 xc_pbe.f90 xc_am05.f90 xc_xalpha.f90 xc_wc06.f90 x_wc06.f90 x_pbe.f90 c_pbe.f90 c_pbe_gcor.f90 xc_vbh.f90 fxc_pwca.f90 phdelete.f90 gendcfun.f90 dmatch.f90 gendvsig.f90 gradrhomt.f90 dpotxc.f90 dolpalo.f90 dhmlalo.f90 dolpaa.f90 dhmllolo.f90 dwavefmt.f90 phonon.f90 dpotks.f90 dhmlaa.f90 dhmlrad.f90 gendwfsv.f90 drhomagk.f90 drhomagsh.f90 hmlaaq.f90 hmlaloq.f90 olpaaq.f90 olpaloq.f90 gengvsmt.f90 dpotcoul.f90 dforcek.f90 gengkqvec.f90 gengqvec.f90 genmcph.f90 deveqnfv.f90 dhmlistl.f90 dolpistl.f90 phmixpack.f90 putdevecfv.f90 getdevecfv.f90 doccupy.f90 putdevecsv.f90 getdevecsv.f90 phononsc.f90 dyntask.f90 genscph.f90 phdisp.f90 readdyn.f90 dynqtor.f90 dynrtoq.f90 dynsymapp.f90 dynsym.f90 dynev.f90 dynevs.f90 phdos.f90 sumrule.f90 writephn.f90 phfext.f90 writegamma.f90 readgamma.f90 phlwidth.f90 alpha2f.f90 writelambda.f90 phscdelete.f90 ephcouple.f90 genephmat.f90 eliashberg.f90 phscdvs.f90 writedvs.f90 readdvs.f90 readalpha2f.f90 mcmillan.f90 dforce.f90 gendsocfr.f90 gendmatmt.f90 genveedu.f90 genvmatmt.f90 writedftu.f90 readalphadu.f90 fyukawa.f90 fyukawa0.f90 genfdufr.f90 energyfdu.f90 writeefdu.f90 zbessela.f90 zbesselb.f90 readdmatmt.f90 genfdu.f90 findlambdadu.f90 readfdu.f90 writetmdu.f90 writetm2du.f90 writetm3du.f90 dmtotm2.f90 dmtotm3.f90 tm2todm.f90 tm3todm.f90 pottm2.f90 pottm3.f90 tm2pol.f90 tm3pol.f90 gendmftm.f90 ftmfield.f90 writeftm.f90 \ rdmft.f90 rdmdkdc.f90 rdmminc.f90 rdmvaryc.f90 rdmdedc.f90 rdmenergy.f90 rdmengyxc.f90 rdmwritededn.f90 rdmwriteengy.f90 rdmminn.f90 rdmvaryn.f90 rdmdedn.f90 rdmdexcdn.f90 genvclijji.f90 genvclijjk.f90 getvclijji.f90 getvclijjk.f90 writevclijji.f90 writevclijjk.f90 rdmdexcdc.f90 rdmdtsdn.f90 rdmentropy.f90 rdmeval.f90 tddft.f90 potkst.f90 timestep.f90 genhmlt.f90 tddftlr.f90 genvfxc.f90 genfxcr.f90 tdtemp.f90 writetimes.f90 readtimes.f90 genspfxcr.f90 genvfxcg.f90 gentimes.f90 tdbackup.f90 tddftsplr.f90 genspfxcg.f90 genafieldt.f90 readafieldt.f90 writetddft.f90 writeafpdt.f90 writetddos.f90 dielectric_tdrt.f90 readcurrent.f90 > elk.lst ./protex -F -s elk.f90 $(cat elk.lst) > elk.tex Use of assignment to $[ is deprecated, and will be fatal in Perl 5.30 at ./protex line 95. pdflatex elk;pdflatex elk;pdflatex elk This is pdfTeX, Version 3.14159265-2.6-1.40.19 (TeX Live 2019/dev/Debian) (preloaded format=pdflatex) restricted \write18 enabled. entering extended mode (./elk.tex LaTeX2e <2018-12-01> (/usr/share/texlive/texmf-dist/tex/latex/base/article.cls Document Class: article 2018/09/03 v1.4i Standard LaTeX document class (/usr/share/texlive/texmf-dist/tex/latex/base/size11.clo)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsmath.sty For additional information on amsmath, use the `?' option. (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amstext.sty (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsgen.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsbsy.sty) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsopn.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amssymb.sty (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amsfonts.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/epsfig.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphicx.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/keyval.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphics.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/trig.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics-cfg/graphics.cfg) (/usr/share/texlive/texmf-dist/tex/latex/graphics-def/pdftex.def)))) (/usr/share/texlive/texmf-dist/tex/latex/tools/tabularx.sty (/usr/share/texlive/texmf-dist/tex/latex/tools/array.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/color.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics-cfg/color.cfg)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/hyperref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/hobsub-hyperref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/hobsub-generic.sty)) (/usr/share/texlive/texmf-dist/tex/generic/ifxetex/ifxetex.sty) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/auxhook.sty) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/kvoptions.sty) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/pd1enc.def) (/usr/share/texlive/texmf-dist/tex/latex/latexconfig/hyperref.cfg) (/usr/share/texlive/texmf-dist/tex/latex/url/url.sty)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/hpdftex.def (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/rerunfilecheck.sty)) No file elk.aux. (/usr/share/texlive/texmf-dist/tex/context/base/mkii/supp-pdf.mkii [Loading MPS to PDF converter (version 2006.09.02).] ) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/epstopdf-base.sty (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/grfext.sty) (/usr/share/texlive/texmf-dist/tex/latex/latexconfig/epstopdf-sys.cfg)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/nameref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/gettitlestring.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsa.fd) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsb.fd) Overfull \hbox (17.24997pt too wide) in paragraph at lines 77--79 [][][][] Underfull \hbox (badness 10000) in paragraph at lines 77--79 [1{/var/lib/texmf/fonts/map/pdftex/updmap/pdftex.map} <./elk_silhouette.pdf>] [2] [3] [4] [5] Overfull \hbox (14.77765pt too wide) in paragraph at lines 296--296 [] \OT1/cmtt/m/n/10.95 1 0 1 2.00000 T : nsp, ls p, ksp, occsp, spcore[] [6] [7] [8] [9] [10] [11] [12] [13] Overfull \hbox (0.95221pt too wide) in paragraph at lines 655--659 []\OT1/cmr/m/n/10.95 If \OT1/cmtt/m/n/10.95 fracinr \OT1/cmr/m/n/10.95 is neg-a -tive then the frac-tion is de-ter-mined from $\OML/cmm/m/it/10.95 f \OT1/cmr/m /n/10.95 = []$ [14] [15] [16] [17] [18] [19] [20] [21] [22] [23] [24] [25] [26] [27] [28] [29] [30] [31] [32] (/usr/share/texlive/texmf-dist/tex/latex/base/omscmr.fd) [33] [34] Underfull \hbox (badness 10000) in paragraph at lines 1652--1653 Overfull \hbox (26.27502pt too wide) in paragraph at lines 1684--1684 [] \OT1/cmtt/m/n/10.95 subroutine atom(sol,ptnucl,zn,nst,n,l,k,occ,xctype,xcgra d,nr,r,eval,rho,vr,rwf) Overfull \hbox (26.27502pt too wide) in paragraph at lines 1702--1702 [] \OT1/cmtt/m/n/10.95 eval : eigenvalue without rest-mass energy for eac h state (out,real(nst))[] [35] Overfull \hbox (20.52634pt too wide) in paragraph at lines 1702--1702 [] \OT1/cmtt/m/n/10.95 rwf : major and minor components of radial wavefu nctions for each state[] Underfull \hbox (badness 10000) in paragraph at lines 1703--1704 Underfull \hbox (badness 10000) in paragraph at lines 1731--1732 [36] Underfull \hbox (badness 10000) in paragraph at lines 1763--1764 Underfull \hbox (badness 10000) in paragraph at lines 1789--1790 Underfull \hbox (badness 10000) in paragraph at lines 1816--1817 [37] Underfull \hbox (badness 10000) in paragraph at lines 1864--1865 [38] Underfull \hbox (badness 10000) in paragraph at lines 1906--1907 Underfull \hbox (badness 10000) in paragraph at lines 1939--1940 [39] Underfull \hbox (badness 10000) in paragraph at lines 1966--1967 Underfull \hbox (badness 10000) in paragraph at lines 2011--2012 Underfull \hbox (badness 10000) in paragraph at lines 2068--2069 [40] Overfull \hbox (20.52634pt too wide) in paragraph at lines 2137--2137 [] \OT1/cmtt/m/n/10.95 tocc : .true. if just the occupied orbitals should contribute to the DOS[] Underfull \hbox (badness 10000) in paragraph at lines 2138--2139 [41] Underfull \hbox (badness 10000) in paragraph at lines 2231--2232 Underfull \hbox (badness 10000) in paragraph at lines 2272--2273 [42] Underfull \hbox (badness 10000) in paragraph at lines 2319--2320 [43] Underfull \hbox (badness 10000) in paragraph at lines 2386--2387 [44] Underfull \hbox (badness 10000) in paragraph at lines 2426--2427 Underfull \hbox (badness 10000) in paragraph at lines 2451--2452 Underfull \hbox (badness 10000) in paragraph at lines 2482--2483 [45] Underfull \hbox (badness 10000) in paragraph at lines 2515--2516 [46] Overfull \hbox (3.28027pt too wide) in paragraph at lines 2546--2546 [] \OT1/cmtt/m/n/10.95 h,o : Hamiltonian and overlap matrices in packed or upper triangular[] Underfull \hbox (badness 10000) in paragraph at lines 2547--2548 Underfull \hbox (badness 10000) in paragraph at lines 2608--2609 [47] Underfull \hbox (badness 10000) in paragraph at lines 2634--2635 Underfull \hbox (badness 10000) in paragraph at lines 2661--2662 [48] Overfull \hbox (32.02371pt too wide) in paragraph at lines 2704--2704 [] \OT1/cmtt/m/n/10.95 demax : maximum allowed change from the input energy ; enforced only if e < 0[] Underfull \hbox (badness 10000) in paragraph at lines 2705--2706 Underfull \hbox (badness 10000) in paragraph at lines 2744--2745 [49] Overfull \hbox (20.52634pt too wide) in paragraph at lines 2779--2779 [] \OT1/cmtt/m/n/10.95 nspnfv : number of first-variational spin components : 1 normal case, 2 for[] Underfull \hbox (badness 10000) in paragraph at lines 2780--2781 Underfull \hbox (badness 10000) in paragraph at lines 2810--2811 [50] Underfull \hbox (badness 10000) in paragraph at lines 2844--2845 [51] Overfull \hbox (9.02896pt too wide) in paragraph at lines 2885--2885 [] \OT1/cmtt/m/n/10.95 lspl : spatial rotation element in lattice point gro up for each symmetry[] Underfull \hbox (badness 10000) in paragraph at lines 2886--2887 Underfull \hbox (badness 10000) in paragraph at lines 2918--2919 [52] Underfull \hbox (badness 10000) in paragraph at lines 2954--2955 Underfull \hbox (badness 10000) in paragraph at lines 2994--2995 [53] [54] Underfull \hbox (badness 10000) in paragraph at lines 3076--3077 Underfull \hbox (badness 10000) in paragraph at lines 3100--3101 [55] Underfull \hbox (badness 10000) in paragraph at lines 3131--3132 Underfull \hbox (badness 10000) in paragraph at lines 3167--3168 [56] Underfull \hbox (badness 10000) in paragraph at lines 3196--3197 Underfull \hbox (badness 10000) in paragraph at lines 3221--3222 [57] Underfull \hbox (badness 10000) in paragraph at lines 3250--3251 Underfull \hbox (badness 10000) in paragraph at lines 3276--3277 Underfull \hbox (badness 10000) in paragraph at lines 3300--3301 [58] Underfull \hbox (badness 10000) in paragraph at lines 3333--3334 [59] Underfull \hbox (badness 10000) in paragraph at lines 3376--3377 Underfull \hbox (badness 10000) in paragraph at lines 3411--3412 [60] Underfull \hbox (badness 10000) in paragraph at lines 3492--3493 Underfull \hbox (badness 10000) in paragraph at lines 3518--3519 [61] Underfull \hbox (badness 10000) in paragraph at lines 3562--3563 Overfull \hbox (3.28027pt too wide) in paragraph at lines 3605--3605 [] \OT1/cmtt/m/n/10.95 subroutine gengkvec(ngvec,ivg,vgc,vkl,vkc,gkmax,ngkmax,n gk,igkig,vgkl,vgkc) [62] Underfull \hbox (badness 10000) in paragraph at lines 3617--3618 Underfull \hbox (badness 10000) in paragraph at lines 3654--3655 [63] Underfull \hbox (badness 10000) in paragraph at lines 3698--3699 Underfull \hbox (badness 10000) in paragraph at lines 3731--3732 [64] Overfull \hbox (26.27502pt too wide) in paragraph at lines 3760--3760 [] \OT1/cmtt/m/n/10.95 first-variational basis; second-variational otherwise (in,logical)[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 3760--3760 [] \OT1/cmtt/m/n/10.95 tvclvr : .true. if the non-local Coulomb potential f rom the core states is[] Underfull \hbox (badness 10000) in paragraph at lines 3761--3762 Underfull \hbox (badness 10000) in paragraph at lines 3788--3789 [65] Overfull \hbox (3.28027pt too wide) in paragraph at lines 3833--3833 [] \OT1/cmtt/m/n/10.95 igpig : index from G+p-vectors to G-vectors (in,inte ger(ngkmax,nspnfv))[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 3833--3833 [] \OT1/cmtt/m/n/10.95 vgpc : G+p-vectors in Cartesian coordinates (in,rea l(3,ngkmax,nspnfv))[] Underfull \hbox (badness 10000) in paragraph at lines 3834--3835 Overfull \hbox (14.77765pt too wide) in paragraph at lines 3864--3864 [] \OT1/cmtt/m/n/10.95 subroutine genppts(tfbz,nsym,sym,ngridp,npptnr,epslat,bv ec,boxl,nppt,ipvip, & Overfull \hbox (32.02371pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 tfbz : .true. if vpl and vpc should be mapped to the first Brillouin zone Overfull \hbox (26.27502pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 nsym : number of point group symmetries used for reduction, set to 1 for[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 npptnr : number of non-reduced p-points: ngridp(1)* ngridp(2)*ngridp(3)[] [66] Overfull \hbox (9.02896pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 boxl : corners of box containing p-points in latt ice coordinates, the[] Underfull \hbox (badness 10000) in paragraph at lines 3891--3892 [67] Underfull \hbox (badness 10000) in paragraph at lines 3933--3934 Underfull \hbox (badness 10000) in paragraph at lines 3968--3969 [68] Underfull \hbox (badness 10000) in paragraph at lines 4002--4003 Underfull \hbox (badness 10000) in paragraph at lines 4029--4030 [69] Underfull \hbox (badness 10000) in paragraph at lines 4053--4054 Overfull \hbox (26.27502pt too wide) in paragraph at lines 4093--4093 [] \OT1/cmtt/m/n/10.95 jlgqr : spherical Bessel functions evaluated on the coarse radial mesh for[] Overfull \hbox (14.77765pt too wide) in paragraph at lines 4093--4093 [] \OT1/cmtt/m/n/10.95 ylmgq : spherical harmonics of the G+q-vectors (in, complex(lmmaxo,ngrf))[] Underfull \hbox (badness 10000) in paragraph at lines 4094--4095 [70] Underfull \hbox (badness 10000) in paragraph at lines 4196--4197 [71] Overfull \hbox (3.28027pt too wide) in paragraph at lines 4219--4219 [] \OT1/cmtt/m/n/10.95 vclijjk : Coulomb matrix elements (out,complex(nstsv ,nstsv,nstsv,nkpt))[] Underfull \hbox (badness 10000) in paragraph at lines 4220--4221 Underfull \hbox (badness 10000) in paragraph at lines 4248--4249 [72] Underfull \hbox (badness 10000) in paragraph at lines 4289--4290 Underfull \hbox (badness 10000) in paragraph at lines 4317--4318 Overfull \hbox (14.77765pt too wide) in paragraph at lines 4344--4344 [] \OT1/cmtt/m/n/10.95 subroutine genwfsv(tsh,tgp,nst,idx,ngdg,igf,ngp,igpig,ap walm,evecfv,evecsv, & Overfull \hbox (20.52634pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 tsh : .true. if wfmt should be in spherical harmo nic basis (in,logical) Overfull \hbox (3.28027pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 tgp : .true. if wfir should be in G+p-space, othe rwise in real-space[] [73] Overfull \hbox (9.02896pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 igpig : index from G+p-vectors to G-vectors (in,int eger(ngkmax,nspnfv))[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 evecfv : first-variational eigenvectors (in,complex( nmatmax,nstfv,nspnfv))[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 wfmt : muffin-tin part of the wavefunctions for ev ery state in spherical[] Underfull \hbox (badness 10000) in paragraph at lines 4365--4366 Underfull \hbox (badness 10000) in paragraph at lines 4402--4403 [74] Underfull \hbox (badness 10000) in paragraph at lines 4430--4431 Overfull \hbox (14.77765pt too wide) in paragraph at lines 4469--4469 [] \OT1/cmtt/m/n/10.95 tsh : .true. if the muffin-tin density is to be i n spherical harmonics Overfull \hbox (20.52634pt too wide) in paragraph at lines 4469--4469 [] \OT1/cmtt/m/n/10.95 tspc : .true. if the density should be contracted over spin (in,logical)[] [75] Underfull \hbox (badness 10000) in paragraph at lines 4470--4471 Overfull \hbox (3.28027pt too wide) in paragraph at lines 4537--4537 [] \OT1/cmtt/m/n/10.95 vgpl : G+p-vectors in lattice coordinates (out,rea l(3,ngkmax,nspnfv))[] Overfull \hbox (26.27502pt too wide) in paragraph at lines 4537--4537 [] \OT1/cmtt/m/n/10.95 evecfv : first-variational eigenvectors (out,complex (nmatmax,nstfv,nspnfv))[] Underfull \hbox (badness 10000) in paragraph at lines 4538--4539 [76] Underfull \hbox (badness 10000) in paragraph at lines 4582--4583 Overfull \hbox (3.28027pt too wide) in paragraph at lines 4606--4606 [] \OT1/cmtt/m/n/10.95 vclijjk : Coulomb matrix elements (out,complex(nstsv ,nstsv,nstsv,nkpt))[] Underfull \hbox (badness 10000) in paragraph at lines 4607--4608 Underfull \hbox (badness 10000) in paragraph at lines 4634--4635 [77] Underfull \hbox (badness 10000) in paragraph at lines 4656--4657 Underfull \hbox (badness 10000) in paragraph at lines 4678--4679 [78] Underfull \hbox (badness 10000) in paragraph at lines 4709--4710 Underfull \hbox (badness 10000) in paragraph at lines 4739--4740 Overfull \hbox (26.27502pt too wide) in paragraph at lines 4765--4765 [] \OT1/cmtt/m/n/10.95 subroutine ggair_sp_2b(g2up,g2dn,gvup,gvdn,vxup,vxdn,vcu p,vcdn,dxdgu2,dxdgd2, & [79] Underfull \hbox (badness 10000) in paragraph at lines 4767--4768 Underfull \hbox (badness 10000) in paragraph at lines 4790--4791 Underfull \hbox (badness 10000) in paragraph at lines 4812--4813 [80] Underfull \hbox (badness 10000) in paragraph at lines 4834--4835 Overfull \hbox (9.02896pt too wide) in paragraph at lines 4854--4854 [] \OT1/cmtt/m/n/10.95 subroutine ggamt_sp_1(is,rhoup,rhodn,grho,gup,gdn,g2up,g 2dn,g3rho,g3up,g3dn) Underfull \hbox (badness 10000) in paragraph at lines 4867--4868 [81] Underfull \hbox (badness 10000) in paragraph at lines 4898--4899 Overfull \hbox (3.28027pt too wide) in paragraph at lines 4954--4954 [] \OT1/cmtt/m/n/10.95 subroutine ggamt_sp_2b(is,g2up,g2dn,gvup,gvdn,vxup,vxdn, vcup,vcdn,dxdgu2, & Underfull \hbox (badness 10000) in paragraph at lines 4956--4957 [82] Underfull \hbox (badness 10000) in paragraph at lines 4983--4984 [83] Underfull \hbox (badness 10000) in paragraph at lines 5025--5026 Underfull \hbox (badness 10000) in paragraph at lines 5075--5076 [84] Underfull \hbox (badness 10000) in paragraph at lines 5120--5121 [85] Underfull \hbox (badness 10000) in paragraph at lines 5152--5153 Overfull \hbox (20.52634pt too wide) in paragraph at lines 5185--5185 [] \OT1/cmtt/m/n/10.95 apwalm : APW matching coefficients (in,complex(ngkma x,apwordmax,lmmaxapw))[] Underfull \hbox (badness 10000) in paragraph at lines 5186--5187 [86] Underfull \hbox (badness 10000) in paragraph at lines 5238--5239 Underfull \hbox (badness 10000) in paragraph at lines 5270--5271 [87] Underfull \hbox (badness 10000) in paragraph at lines 5316--5317 Underfull \hbox (badness 10000) in paragraph at lines 5339--5340 [88] Underfull \hbox (badness 10000) in paragraph at lines 5363--5364 Underfull \hbox (badness 10000) in paragraph at lines 5394--5395 [89] Underfull \hbox (badness 10000) in paragraph at lines 5423--5424 Overfull \hbox (26.27502pt too wide) in paragraph at lines 5475--5475 [] \OT1/cmtt/m/n/10.95 subroutine xcifc_libxc(xctype,n,c_tb09,tempa,rho,rhoup,r hodn,g2rho,g2up,g2dn, & Overfull \hbox (32.02371pt too wide) in paragraph at lines 5475--5475 [] \OT1/cmtt/m/n/10.95 grho2,gup2,gdn2,gupdn,tau,tauup,taudn,ex,ec,vx,vc,vxup, vxdn,vcup,vcdn,dxdgr2, &[] Overfull \hbox (32.02371pt too wide) in paragraph at lines 5475--5475 [] \OT1/cmtt/m/n/10.95 dxdgu2,dxdgd2,dxdgud,dcdgr2,dcdgu2,dcdgd2,dcdgud,dxdg2r ,dxdg2u,dxdg2d,dcdg2r, &[] [90] Underfull \hbox (badness 10000) in paragraph at lines 5521--5522 Overfull \hbox (6.55638pt too wide) in paragraph at lines 5524--5528 \OT1/cmtt/m/n/10.95 http://www.tddft.org/programs/octopus/wiki/index.php/Libxc\ OT1/cmr/m/n/10.95 . The sec-ond and third [91] Underfull \hbox (badness 10000) in paragraph at lines 5550--5551 Underfull \hbox (badness 10000) in paragraph at lines 5578--5579 [92] Underfull \hbox (badness 10000) in paragraph at lines 5614--5615 Underfull \hbox (badness 10000) in paragraph at lines 5655--5656 [93] Overfull \hbox (3.28027pt too wide) in paragraph at lines 5711--5711 [] \OT1/cmtt/m/n/10.95 nu : current output vector as well as the next input vector of the[] Underfull \hbox (badness 10000) in paragraph at lines 5712--5713 [94] Underfull \hbox (badness 10000) in paragraph at lines 5763--5764 Underfull \hbox (badness 10000) in paragraph at lines 5830--5831 [95] Overfull \hbox (9.02896pt too wide) in paragraph at lines 5887--5887 [] \OT1/cmtt/m/n/10.95 subroutine xcifc(xctype,n,c_tb09,tempa,rho,rhoup,rhodn,g rho,gup,gdn,g2rho, & Overfull \hbox (26.27502pt too wide) in paragraph at lines 5887--5887 [] \OT1/cmtt/m/n/10.95 g2up,g2dn,g3rho,g3up,g3dn,grho2,gup2,gdn2,gupdn,tau,tau up,taudn,ex,ec,vx,vc, &[] Overfull \hbox (26.27502pt too wide) in paragraph at lines 5887--5887 [] \OT1/cmtt/m/n/10.95 vxup,vxdn,vcup,vcdn,dxdgr2,dxdgu2,dxdgd2,dxdgud,dcdgr2, dcdgu2,dcdgd2,dcdgud, &[] [96] Underfull \hbox (badness 10000) in paragraph at lines 5939--5940 [97] Underfull \hbox (badness 10000) in paragraph at lines 5973--5974 Underfull \hbox (badness 10000) in paragraph at lines 6005--6006 [98] Underfull \hbox (badness 10000) in paragraph at lines 6028--6029 Underfull \hbox (badness 10000) in paragraph at lines 6059--6060 [99] Underfull \hbox (badness 10000) in paragraph at lines 6087--6088 Underfull \hbox (badness 10000) in paragraph at lines 6112--6113 Underfull \hbox (badness 10000) in paragraph at lines 6151--6152 [100] Underfull \hbox (badness 10000) in paragraph at lines 6217--6218 Underfull \hbox (badness 10000) in paragraph at lines 6247--6248 [101] Underfull \hbox (badness 10000) in paragraph at lines 6287--6288 [102] Underfull \hbox (badness 10000) in paragraph at lines 6361--6362 Underfull \hbox (badness 10000) in paragraph at lines 6389--6390 [103] Underfull \hbox (badness 10000) in paragraph at lines 6417--6418 Overfull \hbox (3.28027pt too wide) in paragraph at lines 6448--6448 [] \OT1/cmtt/m/n/10.95 vpl : connecting point vectors in lattice coordinat es (out,real(3,np))[] Underfull \hbox (badness 10000) in paragraph at lines 6449--6450 [104] Underfull \hbox (badness 10000) in paragraph at lines 6491--6492 Underfull \hbox (badness 10000) in paragraph at lines 6517--6518 [105] Underfull \hbox (badness 10000) in paragraph at lines 6548--6549 Overfull \hbox (0.21347pt too wide) in paragraph at lines 6551--6554 []\OT1/cmr/m/n/10.95 Computes the Kohn-Sham ef-fec-tive po-ten-tial by adding t o-gether the Coulomb and exchange- Underfull \hbox (badness 10000) in paragraph at lines 6580--6581 [106] Underfull \hbox (badness 10000) in paragraph at lines 6608--6609 Underfull \hbox (badness 10000) in paragraph at lines 6636--6637 [107] Underfull \hbox (badness 10000) in paragraph at lines 6666--6667 Overfull \hbox (26.27502pt too wide) in paragraph at lines 6690--6690 [] \OT1/cmtt/m/n/10.95 subroutine potxc(tsh,xctype_,rhomt_,rhoir_,magmt_,magir_ ,taumt_,tauir_,exmt_, & Underfull \hbox (badness 10000) in paragraph at lines 6693--6694 [108] Underfull \hbox (badness 10000) in paragraph at lines 6778--6779 Underfull \hbox (badness 10000) in paragraph at lines 6801--6802 Underfull \hbox (badness 10000) in paragraph at lines 6826--6827 [109] Underfull \hbox (badness 10000) in paragraph at lines 6849--6850 Underfull \hbox (badness 10000) in paragraph at lines 6873--6874 [110] Underfull \hbox (badness 10000) in paragraph at lines 6897--6898 Underfull \hbox (badness 10000) in paragraph at lines 6921--6922 Underfull \hbox (badness 10000) in paragraph at lines 6945--6946 [111] Underfull \hbox (badness 10000) in paragraph at lines 6969--6970 Underfull \hbox (badness 10000) in paragraph at lines 6995--6996 [112] Underfull \hbox (badness 10000) in paragraph at lines 7037--7038 [113] Underfull \hbox (badness 10000) in paragraph at lines 7076--7077 [114] Underfull \hbox (badness 10000) in paragraph at lines 7115--7116 Overfull \hbox (0.44627pt too wide) in paragraph at lines 7118--7120 []\OT1/cmr/m/n/10.95 Calculates the deriva-tive of the to-tal en-ergy w.r.t. th e second-variational co-ef-fi-cients \OT1/cmtt/m/n/10.95 evecsv\OT1/cmr/m/n/10. 95 . Underfull \hbox (badness 10000) in paragraph at lines 7141--7142 Underfull \hbox (badness 10000) in paragraph at lines 7166--7167 [115] Underfull \hbox (badness 10000) in paragraph at lines 7191--7192 Underfull \hbox (badness 10000) in paragraph at lines 7216--7217 [116] Underfull \hbox (badness 10000) in paragraph at lines 7241--7242 Underfull \hbox (badness 10000) in paragraph at lines 7267--7268 [117] Underfull \hbox (badness 10000) in paragraph at lines 7291--7292 Underfull \hbox (badness 10000) in paragraph at lines 7314--7315 Underfull \hbox (badness 10000) in paragraph at lines 7339--7340 [118] Underfull \hbox (badness 10000) in paragraph at lines 7365--7366 Underfull \hbox (badness 10000) in paragraph at lines 7389--7390 [119] Underfull \hbox (badness 10000) in paragraph at lines 7414--7415 Underfull \hbox (badness 10000) in paragraph at lines 7438--7439 Underfull \hbox (badness 10000) in paragraph at lines 7463--7464 [120] Underfull \hbox (badness 10000) in paragraph at lines 7494--7495 Overfull \hbox (5.17302pt too wide) in paragraph at lines 7497--7499 []\OT1/cmr/m/n/10.95 Writes the deriva-tive of to-tal en-ergy with re-spect to oc-cu-pa-tion num-bers to file \OT1/cmtt/m/n/10.95 RDM[]DEDN.OUT\OT1/cmr/m/n/10 .95 . Underfull \hbox (badness 10000) in paragraph at lines 7519--7520 [121] Underfull \hbox (badness 10000) in paragraph at lines 7577--7578 [122] Underfull \hbox (badness 10000) in paragraph at lines 7617--7618 Underfull \hbox (badness 10000) in paragraph at lines 7645--7646 Underfull \hbox (badness 10000) in paragraph at lines 7675--7676 [123] Overfull \hbox (3.28027pt too wide) in paragraph at lines 7719--7719 [] \OT1/cmtt/m/n/10.95 rfir1 : first real interstitial function in real-spa ce (in,real(ngtot))[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 7719--7719 [] \OT1/cmtt/m/n/10.95 rfmt2 : second function in real spherical harmonics for all muffin-tins[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 7719--7719 [] \OT1/cmtt/m/n/10.95 rfir2 : second real interstitial function in real-sp ace (in,real(ngtot))[] Underfull \hbox (badness 10000) in paragraph at lines 7720--7721 [124] Underfull \hbox (badness 10000) in paragraph at lines 7764--7765 Underfull \hbox (badness 10000) in paragraph at lines 7795--7796 [125] Overfull \hbox (9.02896pt too wide) in paragraph at lines 7828--7828 [] \OT1/cmtt/m/n/10.95 nri : number of radial mesh points on the inner pa rt of the muffin-tin[] Underfull \hbox (badness 10000) in paragraph at lines 7829--7830 Underfull \hbox (badness 10000) in paragraph at lines 7883--7884 [126] Underfull \hbox (badness 10000) in paragraph at lines 7909--7910 Overfull \hbox (9.02896pt too wide) in paragraph at lines 7947--7947 [] \OT1/cmtt/m/n/10.95 igpig : index from G+p-vectors to G-vectors (in,int eger(ngkmax,nspnfv))[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 7947--7947 [] \OT1/cmtt/m/n/10.95 evecfv : first-variational eigenvectors (in,complex( nmatmax,nstfv,nspnfv))[] Underfull \hbox (badness 10000) in paragraph at lines 7948--7949 [127] Underfull \hbox (badness 10000) in paragraph at lines 7983--7984 [128] Underfull \hbox (badness 10000) in paragraph at lines 8006--8007 Underfull \hbox (badness 10000) in paragraph at lines 8033--8034 Underfull \hbox (badness 10000) in paragraph at lines 8060--8061 [129] Underfull \hbox (badness 10000) in paragraph at lines 8112--8113 [130] Underfull \hbox (badness 10000) in paragraph at lines 8155--8156 [131] Underfull \hbox (badness 10000) in paragraph at lines 8211--8212 Overfull \hbox (14.77765pt too wide) in paragraph at lines 8249--8249 [] \OT1/cmtt/m/n/10.95 zflm1 : coefficients of the complex spherical harmon ic expansion for each[] Underfull \hbox (badness 10000) in paragraph at lines 8250--8251 [132] Underfull \hbox (badness 10000) in paragraph at lines 8288--8289 [133] Underfull \hbox (badness 10000) in paragraph at lines 8331--8332 [134] Underfull \hbox (badness 10000) in paragraph at lines 8368--8369 Underfull \hbox (badness 10000) in paragraph at lines 8402--8403 [135] Underfull \hbox (badness 10000) in paragraph at lines 8436--8437 [136] Underfull \hbox (badness 10000) in paragraph at lines 8475--8476 Underfull \hbox (badness 10000) in paragraph at lines 8510--8511 [137] Underfull \hbox (badness 10000) in paragraph at lines 8533--8534 Underfull \hbox (badness 10000) in paragraph at lines 8561--8562 [138] Underfull \hbox (badness 10000) in paragraph at lines 8592--8593 Underfull \hbox (badness 10000) in paragraph at lines 8623--8624 [139] Underfull \hbox (badness 10000) in paragraph at lines 8653--8654 Underfull \hbox (badness 10000) in paragraph at lines 8685--8686 [140] Underfull \hbox (badness 10000) in paragraph at lines 8711--8712 Underfull \hbox (badness 10000) in paragraph at lines 8743--8744 [141] Underfull \hbox (badness 10000) in paragraph at lines 8774--8775 Underfull \hbox (badness 10000) in paragraph at lines 8822--8823 [142] Underfull \hbox (badness 10000) in paragraph at lines 8847--8848 Underfull \hbox (badness 10000) in paragraph at lines 8875--8876 [143] Underfull \hbox (badness 10000) in paragraph at lines 8908--8909 Underfull \hbox (badness 10000) in paragraph at lines 8939--8940 [144] Overfull \hbox (3.28027pt too wide) in paragraph at lines 8989--8989 [] \OT1/cmtt/m/n/10.95 nri : number of radial points on the inner part (in ,integer(nspecies))[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 8989--8989 [] \OT1/cmtt/m/n/10.95 np : total number of points in each muffin-tin (in ,integer(nspecies))[] Underfull \hbox (badness 10000) in paragraph at lines 8990--8991 Underfull \hbox (badness 10000) in paragraph at lines 9019--9020 [145] Overfull \hbox (3.28027pt too wide) in paragraph at lines 9057--9057 [] \OT1/cmtt/m/n/10.95 nr : number of radial points for each species (in ,integer(nspecies))[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 9057--9057 [] \OT1/cmtt/m/n/10.95 nri : number of radial points on the inner part (i n,integer(nspecies))[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 9057--9057 [] \OT1/cmtt/m/n/10.95 np : total number of points in each muffin-tin (i n,integer(nspecies))[] Underfull \hbox (badness 10000) in paragraph at lines 9058--9059 [146] Underfull \hbox (badness 10000) in paragraph at lines 9094--9095 Overfull \hbox (26.27502pt too wide) in paragraph at lines 9125--9125 [] \OT1/cmtt/m/n/10.95 vca : vectors in Cartesian coordinates for all ato ms (in,real(3,natmtot)) Underfull \hbox (badness 10000) in paragraph at lines 9126--9127 Underfull \hbox (badness 10000) in paragraph at lines 9174--9175 [147] Underfull \hbox (badness 10000) in paragraph at lines 9226--9227 Underfull \hbox (badness 10000) in paragraph at lines 9249--9250 [148] Overfull \hbox (20.52634pt too wide) in paragraph at lines 9291--9291 [] \OT1/cmtt/m/n/10.95 apwalm : APW matching coefficients (in,complex(ngkma x,apwordmax,lmmaxapw))[] Underfull \hbox (badness 10000) in paragraph at lines 9292--9293 Underfull \hbox (badness 10000) in paragraph at lines 9340--9341 [149] Underfull \hbox (badness 10000) in paragraph at lines 9374--9375 Underfull \hbox (badness 10000) in paragraph at lines 9400--9401 [150] Underfull \hbox (badness 10000) in paragraph at lines 9465--9466 [151] Underfull \hbox (badness 10000) in paragraph at lines 9488--9489 Underfull \hbox (badness 10000) in paragraph at lines 9530--9531 [152] Underfull \hbox (badness 10000) in paragraph at lines 9565--9566 Underfull \hbox (badness 10000) in paragraph at lines 9603--9604 Underfull \hbox (badness 10000) in paragraph at lines 9629--9630 [153] Underfull \hbox (badness 10000) in paragraph at lines 9657--9658 Underfull \hbox (badness 10000) in paragraph at lines 9684--9685 [154] Underfull \hbox (badness 10000) in paragraph at lines 9708--9709 Underfull \hbox (badness 10000) in paragraph at lines 9739--9740 Overfull \hbox (16.14984pt too wide) in paragraph at lines 9742--9744 []\OT1/cmr/m/n/10.95 Writes the lin-eari-sa-tion en-er-gies for all APW and loc al-orbital func-tions to the file \OT1/cmtt/m/n/10.95 LINENGY.OUT\OT1/cmr/m/n/1 0.95 . [155] Underfull \hbox (badness 10000) in paragraph at lines 9771--9772 Underfull \hbox (badness 10000) in paragraph at lines 9807--9808 Underfull \hbox (badness 10000) in paragraph at lines 9839--9840 [156] Underfull \hbox (badness 10000) in paragraph at lines 9878--9879 Underfull \hbox (badness 10000) in paragraph at lines 9903--9904 [157] Underfull \hbox (badness 10000) in paragraph at lines 9932--9933 Underfull \hbox (badness 10000) in paragraph at lines 9957--9958 [158] Underfull \hbox (badness 10000) in paragraph at lines 10005--10006 Underfull \hbox (badness 10000) in paragraph at lines 10031--10032 [159] Underfull \hbox (badness 10000) in paragraph at lines 10052--10053 Underfull \hbox (badness 10000) in paragraph at lines 10072--10073 Underfull \hbox (badness 10000) in paragraph at lines 10094--10095 [160] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10122--10122 [] \OT1/cmtt/m/n/10.95 subroutine xc_pbe(n,kappa,mu,beta,rhoup,rhodn,grho,gup,g dn,g2up,g2dn,g3rho, & Underfull \hbox (badness 10000) in paragraph at lines 10143--10144 [161] Underfull \hbox (badness 10000) in paragraph at lines 10179--10180 Underfull \hbox (badness 10000) in paragraph at lines 10209--10210 [162] Underfull \hbox (badness 10000) in paragraph at lines 10242--10243 [163] Underfull \hbox (badness 10000) in paragraph at lines 10274--10275 Underfull \hbox (badness 10000) in paragraph at lines 10301--10302 [164] Overfull \hbox (3.28027pt too wide) in paragraph at lines 10333--10333 [] \OT1/cmtt/m/n/10.95 dy : rotation matrix for complex spherical harmoni cs (out,real(ld,*))[] Underfull \hbox (badness 10000) in paragraph at lines 10334--10335 Underfull \hbox (badness 10000) in paragraph at lines 10367--10368 [165] Underfull \hbox (badness 10000) in paragraph at lines 10392--10393 Underfull \hbox (badness 10000) in paragraph at lines 10417--10418 Underfull \hbox (badness 10000) in paragraph at lines 10442--10443 [166] Underfull \hbox (badness 10000) in paragraph at lines 10473--10474 [167] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10509--10509 [] \OT1/cmtt/m/n/10.95 nri : number of points on the inner part of the mu ffin-tin (in,integer)[] Underfull \hbox (badness 10000) in paragraph at lines 10510--10511 Overfull \hbox (14.77765pt too wide) in paragraph at lines 10546--10546 [] \OT1/cmtt/m/n/10.95 zfmt1 : first complex function in spherical harmonic s/coordinates for all Overfull \hbox (20.52634pt too wide) in paragraph at lines 10546--10546 [] \OT1/cmtt/m/n/10.95 zfmt2 : second complex function in spherical harmoni cs/coordinates for all[] [168] Underfull \hbox (badness 10000) in paragraph at lines 10547--10548 Underfull \hbox (badness 10000) in paragraph at lines 10577--10578 [169] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10622--10622 [] \OT1/cmtt/m/n/10.95 nri : number of points on the inner part of the mu ffin-tin (in,integer)[] Underfull \hbox (badness 10000) in paragraph at lines 10623--10624 Overfull \hbox (14.77765pt too wide) in paragraph at lines 10674--10674 [] \OT1/cmtt/m/n/10.95 nri : number of points on the inner part of the mu ffin-tin (in,integer)[] [170] Underfull \hbox (badness 10000) in paragraph at lines 10675--10676 Underfull \hbox (badness 10000) in paragraph at lines 10706--10707 [171] Underfull \hbox (badness 10000) in paragraph at lines 10755--10756 Overfull \hbox (14.77765pt too wide) in paragraph at lines 10782--10782 [] \OT1/cmtt/m/n/10.95 subroutine zpotcoul(nr,nri,np,npi,ld1,r,ngdg,igf,ngp,gpc ,gclgp,ld2,jlgprmt, & Overfull \hbox (14.77765pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 nr : number of radial points for each species ( in,integer(nspecies)) [172] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 jlgprmt : spherical Bessel functions for evergy G+p- vector and muffin-tin[] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 ylmgp : spherical harmonics of the G+p-vectors (in ,complex(lmmaxo,ngp))[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 sfacgp : structure factors of the G+p-vectors (in,c omplex(ld2,natmtot))[] Underfull \hbox (badness 10000) in paragraph at lines 10807--10808 [173] Underfull \hbox (badness 10000) in paragraph at lines 10888--10889 [174] Underfull \hbox (badness 10000) in paragraph at lines 10923--10924 [175] (./elk.aux) Package rerunfilecheck Warning: File `elk.out' has changed. (rerunfilecheck) Rerun to get outlines right (rerunfilecheck) or use package `bookmark'. LaTeX Warning: Label(s) may have changed. Rerun to get cross-references right. ) (see the transcript file for additional information) Output written on elk.pdf (175 pages, 631890 bytes). Transcript written on elk.log. This is pdfTeX, Version 3.14159265-2.6-1.40.19 (TeX Live 2019/dev/Debian) (preloaded format=pdflatex) restricted \write18 enabled. entering extended mode (./elk.tex LaTeX2e <2018-12-01> (/usr/share/texlive/texmf-dist/tex/latex/base/article.cls Document Class: article 2018/09/03 v1.4i Standard LaTeX document class (/usr/share/texlive/texmf-dist/tex/latex/base/size11.clo)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsmath.sty For additional information on amsmath, use the `?' option. (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amstext.sty (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsgen.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsbsy.sty) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsopn.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amssymb.sty (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amsfonts.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/epsfig.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphicx.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/keyval.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphics.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/trig.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics-cfg/graphics.cfg) (/usr/share/texlive/texmf-dist/tex/latex/graphics-def/pdftex.def)))) (/usr/share/texlive/texmf-dist/tex/latex/tools/tabularx.sty (/usr/share/texlive/texmf-dist/tex/latex/tools/array.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/color.sty 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(/usr/share/texlive/texmf-dist/tex/latex/oberdiek/grfext.sty) (/usr/share/texlive/texmf-dist/tex/latex/latexconfig/epstopdf-sys.cfg)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/nameref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/gettitlestring.sty)) (./elk.out) (./elk.out) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsa.fd) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsb.fd) Overfull \hbox (17.24997pt too wide) in paragraph at lines 77--79 [][][][] Underfull \hbox (badness 10000) in paragraph at lines 77--79 [1{/var/lib/texmf/fonts/map/pdftex/updmap/pdftex.map} <./elk_silhouette.pdf>] (./elk.toc [2] [3] [4] [5] [6] [7] [8] [9]) [10] [11] [12] [13] Overfull \hbox (14.77765pt too wide) in paragraph at lines 296--296 [] \OT1/cmtt/m/n/10.95 1 0 1 2.00000 T : nsp, ls p, ksp, occsp, spcore[] [14] [15] [16] [17] [18] [19] [20] [21] Overfull \hbox (0.95221pt too wide) in paragraph at lines 655--659 []\OT1/cmr/m/n/10.95 If \OT1/cmtt/m/n/10.95 fracinr \OT1/cmr/m/n/10.95 is neg-a -tive then the frac-tion is de-ter-mined from $\OML/cmm/m/it/10.95 f \OT1/cmr/m /n/10.95 = []$ [22] [23] [24] [25] [26] [27] [28] [29] [30] [31] [32] [33] [34] [35] [36] [37] [38] [39] [40] (/usr/share/texlive/texmf-dist/tex/latex/base/omscmr.fd) [41] [42] Underfull \hbox (badness 10000) in paragraph at lines 1652--1653 Overfull \hbox (26.27502pt too wide) in paragraph at lines 1684--1684 [] \OT1/cmtt/m/n/10.95 subroutine atom(sol,ptnucl,zn,nst,n,l,k,occ,xctype,xcgra d,nr,r,eval,rho,vr,rwf) Overfull \hbox (26.27502pt too wide) in paragraph at lines 1702--1702 [] \OT1/cmtt/m/n/10.95 eval : eigenvalue without rest-mass energy for eac h state (out,real(nst))[] [43] Overfull \hbox (20.52634pt too wide) in paragraph at lines 1702--1702 [] \OT1/cmtt/m/n/10.95 rwf : major and minor components of radial wavefu nctions for each state[] Underfull \hbox (badness 10000) in paragraph at lines 1703--1704 Underfull \hbox (badness 10000) in paragraph at lines 1731--1732 [44] Underfull \hbox (badness 10000) in paragraph at lines 1763--1764 Underfull \hbox (badness 10000) in paragraph at lines 1789--1790 Underfull \hbox (badness 10000) in paragraph at lines 1816--1817 [45] Underfull \hbox (badness 10000) in paragraph at lines 1864--1865 [46] Underfull \hbox (badness 10000) in paragraph at lines 1906--1907 Underfull \hbox (badness 10000) in paragraph at lines 1939--1940 [47] Underfull \hbox (badness 10000) in paragraph at lines 1966--1967 Underfull \hbox (badness 10000) in paragraph at lines 2011--2012 Underfull \hbox (badness 10000) in paragraph at lines 2068--2069 [48] Overfull \hbox (20.52634pt too wide) in paragraph at lines 2137--2137 [] \OT1/cmtt/m/n/10.95 tocc : .true. if just the occupied orbitals should contribute to the DOS[] Underfull \hbox (badness 10000) in paragraph at lines 2138--2139 [49] Underfull \hbox (badness 10000) in paragraph at lines 2231--2232 Underfull \hbox (badness 10000) in paragraph at lines 2272--2273 [50] Underfull \hbox (badness 10000) in paragraph at lines 2319--2320 [51] Underfull \hbox (badness 10000) in paragraph at lines 2386--2387 [52] Underfull \hbox (badness 10000) in paragraph at lines 2426--2427 Underfull \hbox (badness 10000) in paragraph at lines 2451--2452 Underfull \hbox (badness 10000) in paragraph at lines 2482--2483 [53] Underfull \hbox (badness 10000) in paragraph at lines 2515--2516 [54] Overfull \hbox (3.28027pt too wide) in paragraph at lines 2546--2546 [] \OT1/cmtt/m/n/10.95 h,o : Hamiltonian and overlap matrices in packed or upper triangular[] Underfull \hbox (badness 10000) in paragraph at lines 2547--2548 Underfull \hbox (badness 10000) in paragraph at lines 2608--2609 [55] Underfull \hbox (badness 10000) in paragraph at lines 2634--2635 Underfull \hbox (badness 10000) in paragraph at lines 2661--2662 [56] Overfull \hbox (32.02371pt too wide) in paragraph at lines 2704--2704 [] \OT1/cmtt/m/n/10.95 demax : maximum allowed change from the input energy ; enforced only if e < 0[] Underfull \hbox (badness 10000) in paragraph at lines 2705--2706 Underfull \hbox (badness 10000) in paragraph at lines 2744--2745 [57] Overfull \hbox (20.52634pt too wide) in paragraph at lines 2779--2779 [] \OT1/cmtt/m/n/10.95 nspnfv : number of first-variational spin components : 1 normal case, 2 for[] Underfull \hbox (badness 10000) in paragraph at lines 2780--2781 Underfull \hbox (badness 10000) in paragraph at lines 2810--2811 [58] Underfull \hbox (badness 10000) in paragraph at lines 2844--2845 [59] Overfull \hbox (9.02896pt too wide) in paragraph at lines 2885--2885 [] \OT1/cmtt/m/n/10.95 lspl : spatial rotation element in lattice point gro up for each symmetry[] Underfull \hbox (badness 10000) in paragraph at lines 2886--2887 Underfull \hbox (badness 10000) in paragraph at lines 2918--2919 [60] Underfull \hbox (badness 10000) in paragraph at lines 2954--2955 Underfull \hbox (badness 10000) in paragraph at lines 2994--2995 [61] [62] Underfull \hbox (badness 10000) in paragraph at lines 3076--3077 Underfull \hbox (badness 10000) in paragraph at lines 3100--3101 [63] Underfull \hbox (badness 10000) in paragraph at lines 3131--3132 Underfull \hbox (badness 10000) in paragraph at lines 3167--3168 [64] Underfull \hbox (badness 10000) in paragraph at lines 3196--3197 Underfull \hbox (badness 10000) in paragraph at lines 3221--3222 [65] Underfull \hbox (badness 10000) in paragraph at lines 3250--3251 Underfull \hbox (badness 10000) in paragraph at lines 3276--3277 Underfull \hbox (badness 10000) in paragraph at lines 3300--3301 [66] Underfull \hbox (badness 10000) in paragraph at lines 3333--3334 [67] Underfull \hbox (badness 10000) in paragraph at lines 3376--3377 Underfull \hbox (badness 10000) in paragraph at lines 3411--3412 [68] Underfull \hbox (badness 10000) in paragraph at lines 3492--3493 Underfull \hbox (badness 10000) in paragraph at lines 3518--3519 [69] Underfull \hbox (badness 10000) in paragraph at lines 3562--3563 Overfull \hbox (3.28027pt too wide) in paragraph at lines 3605--3605 [] \OT1/cmtt/m/n/10.95 subroutine gengkvec(ngvec,ivg,vgc,vkl,vkc,gkmax,ngkmax,n gk,igkig,vgkl,vgkc) [70] Underfull \hbox (badness 10000) in paragraph at lines 3617--3618 Underfull \hbox (badness 10000) in paragraph at lines 3654--3655 [71] Underfull \hbox (badness 10000) in paragraph at lines 3698--3699 Underfull \hbox (badness 10000) in paragraph at lines 3731--3732 [72] Overfull \hbox (26.27502pt too wide) in paragraph at lines 3760--3760 [] \OT1/cmtt/m/n/10.95 first-variational basis; second-variational otherwise (in,logical)[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 3760--3760 [] \OT1/cmtt/m/n/10.95 tvclvr : .true. if the non-local Coulomb potential f rom the core states is[] Underfull \hbox (badness 10000) in paragraph at lines 3761--3762 Underfull \hbox (badness 10000) in paragraph at lines 3788--3789 [73] Overfull \hbox (3.28027pt too wide) in paragraph at lines 3833--3833 [] \OT1/cmtt/m/n/10.95 igpig : index from G+p-vectors to G-vectors (in,inte ger(ngkmax,nspnfv))[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 3833--3833 [] \OT1/cmtt/m/n/10.95 vgpc : G+p-vectors in Cartesian coordinates (in,rea l(3,ngkmax,nspnfv))[] Underfull \hbox (badness 10000) in paragraph at lines 3834--3835 Overfull \hbox (14.77765pt too wide) in paragraph at lines 3864--3864 [] \OT1/cmtt/m/n/10.95 subroutine genppts(tfbz,nsym,sym,ngridp,npptnr,epslat,bv ec,boxl,nppt,ipvip, & Overfull \hbox (32.02371pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 tfbz : .true. if vpl and vpc should be mapped to the first Brillouin zone Overfull \hbox (26.27502pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 nsym : number of point group symmetries used for reduction, set to 1 for[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 npptnr : number of non-reduced p-points: ngridp(1)* ngridp(2)*ngridp(3)[] [74] Overfull \hbox (9.02896pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 boxl : corners of box containing p-points in latt ice coordinates, the[] Underfull \hbox (badness 10000) in paragraph at lines 3891--3892 [75] Underfull \hbox (badness 10000) in paragraph at lines 3933--3934 Underfull \hbox (badness 10000) in paragraph at lines 3968--3969 [76] Underfull \hbox (badness 10000) in paragraph at lines 4002--4003 Underfull \hbox (badness 10000) in paragraph at lines 4029--4030 [77] Underfull \hbox (badness 10000) in paragraph at lines 4053--4054 Overfull \hbox (26.27502pt too wide) in paragraph at lines 4093--4093 [] \OT1/cmtt/m/n/10.95 jlgqr : spherical Bessel functions evaluated on the coarse radial mesh for[] Overfull \hbox (14.77765pt too wide) in paragraph at lines 4093--4093 [] \OT1/cmtt/m/n/10.95 ylmgq : spherical harmonics of the G+q-vectors (in, complex(lmmaxo,ngrf))[] Underfull \hbox (badness 10000) in paragraph at lines 4094--4095 [78] Underfull \hbox (badness 10000) in paragraph at lines 4196--4197 [79] Overfull \hbox (3.28027pt too wide) in paragraph at lines 4219--4219 [] \OT1/cmtt/m/n/10.95 vclijjk : Coulomb matrix elements (out,complex(nstsv ,nstsv,nstsv,nkpt))[] Underfull \hbox (badness 10000) in paragraph at lines 4220--4221 Underfull \hbox (badness 10000) in paragraph at lines 4248--4249 [80] Underfull \hbox (badness 10000) in paragraph at lines 4289--4290 Underfull \hbox (badness 10000) in paragraph at lines 4317--4318 Overfull \hbox (14.77765pt too wide) in paragraph at lines 4344--4344 [] \OT1/cmtt/m/n/10.95 subroutine genwfsv(tsh,tgp,nst,idx,ngdg,igf,ngp,igpig,ap walm,evecfv,evecsv, & Overfull \hbox (20.52634pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 tsh : .true. if wfmt should be in spherical harmo nic basis (in,logical) Overfull \hbox (3.28027pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 tgp : .true. if wfir should be in G+p-space, othe rwise in real-space[] [81] Overfull \hbox (9.02896pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 igpig : index from G+p-vectors to G-vectors (in,int eger(ngkmax,nspnfv))[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 evecfv : first-variational eigenvectors (in,complex( nmatmax,nstfv,nspnfv))[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 wfmt : muffin-tin part of the wavefunctions for ev ery state in spherical[] Underfull \hbox (badness 10000) in paragraph at lines 4365--4366 Underfull \hbox (badness 10000) in paragraph at lines 4402--4403 [82] Underfull \hbox (badness 10000) in paragraph at lines 4430--4431 Overfull \hbox (14.77765pt too wide) in paragraph at lines 4469--4469 [] \OT1/cmtt/m/n/10.95 tsh : .true. if the muffin-tin density is to be i n spherical harmonics Overfull \hbox (20.52634pt too wide) in paragraph at lines 4469--4469 [] \OT1/cmtt/m/n/10.95 tspc : .true. if the density should be contracted over spin (in,logical)[] [83] Underfull \hbox (badness 10000) in paragraph at lines 4470--4471 Overfull \hbox (3.28027pt too wide) in paragraph at lines 4537--4537 [] \OT1/cmtt/m/n/10.95 vgpl : G+p-vectors in lattice coordinates (out,rea l(3,ngkmax,nspnfv))[] Overfull \hbox (26.27502pt too wide) in paragraph at lines 4537--4537 [] \OT1/cmtt/m/n/10.95 evecfv : first-variational eigenvectors (out,complex (nmatmax,nstfv,nspnfv))[] Underfull \hbox (badness 10000) in paragraph at lines 4538--4539 [84] Underfull \hbox (badness 10000) in paragraph at lines 4582--4583 Overfull \hbox (3.28027pt too wide) in paragraph at lines 4606--4606 [] \OT1/cmtt/m/n/10.95 vclijjk : Coulomb matrix elements (out,complex(nstsv ,nstsv,nstsv,nkpt))[] Underfull \hbox (badness 10000) in paragraph at lines 4607--4608 Underfull \hbox (badness 10000) in paragraph at lines 4634--4635 [85] Underfull \hbox (badness 10000) in paragraph at lines 4656--4657 Underfull \hbox (badness 10000) in paragraph at lines 4678--4679 [86] Underfull \hbox (badness 10000) in paragraph at lines 4709--4710 Underfull \hbox (badness 10000) in paragraph at lines 4739--4740 Overfull \hbox (26.27502pt too wide) in paragraph at lines 4765--4765 [] \OT1/cmtt/m/n/10.95 subroutine ggair_sp_2b(g2up,g2dn,gvup,gvdn,vxup,vxdn,vcu p,vcdn,dxdgu2,dxdgd2, & [87] Underfull \hbox (badness 10000) in paragraph at lines 4767--4768 Underfull \hbox (badness 10000) in paragraph at lines 4790--4791 Underfull \hbox (badness 10000) in paragraph at lines 4812--4813 [88] Underfull \hbox (badness 10000) in paragraph at lines 4834--4835 Overfull \hbox (9.02896pt too wide) in paragraph at lines 4854--4854 [] \OT1/cmtt/m/n/10.95 subroutine ggamt_sp_1(is,rhoup,rhodn,grho,gup,gdn,g2up,g 2dn,g3rho,g3up,g3dn) Underfull \hbox (badness 10000) in paragraph at lines 4867--4868 [89] Underfull \hbox (badness 10000) in paragraph at lines 4898--4899 Overfull \hbox (3.28027pt too wide) in paragraph at lines 4954--4954 [] \OT1/cmtt/m/n/10.95 subroutine ggamt_sp_2b(is,g2up,g2dn,gvup,gvdn,vxup,vxdn, vcup,vcdn,dxdgu2, & Underfull \hbox (badness 10000) in paragraph at lines 4956--4957 [90] Underfull \hbox (badness 10000) in paragraph at lines 4983--4984 [91] Underfull \hbox (badness 10000) in paragraph at lines 5025--5026 Underfull \hbox (badness 10000) in paragraph at lines 5075--5076 [92] Underfull \hbox (badness 10000) in paragraph at lines 5120--5121 [93] Underfull \hbox (badness 10000) in paragraph at lines 5152--5153 Overfull \hbox (20.52634pt too wide) in paragraph at lines 5185--5185 [] \OT1/cmtt/m/n/10.95 apwalm : APW matching coefficients (in,complex(ngkma x,apwordmax,lmmaxapw))[] Underfull \hbox (badness 10000) in paragraph at lines 5186--5187 [94] Underfull \hbox (badness 10000) in paragraph at lines 5238--5239 Underfull \hbox (badness 10000) in paragraph at lines 5270--5271 [95] Underfull \hbox (badness 10000) in paragraph at lines 5316--5317 Underfull \hbox (badness 10000) in paragraph at lines 5339--5340 [96] Underfull \hbox (badness 10000) in paragraph at lines 5363--5364 Underfull \hbox (badness 10000) in paragraph at lines 5394--5395 [97] Underfull \hbox (badness 10000) in paragraph at lines 5423--5424 Overfull \hbox (26.27502pt too wide) in paragraph at lines 5475--5475 [] \OT1/cmtt/m/n/10.95 subroutine xcifc_libxc(xctype,n,c_tb09,tempa,rho,rhoup,r hodn,g2rho,g2up,g2dn, & Overfull \hbox (32.02371pt too wide) in paragraph at lines 5475--5475 [] \OT1/cmtt/m/n/10.95 grho2,gup2,gdn2,gupdn,tau,tauup,taudn,ex,ec,vx,vc,vxup, vxdn,vcup,vcdn,dxdgr2, &[] Overfull \hbox (32.02371pt too wide) in paragraph at lines 5475--5475 [] \OT1/cmtt/m/n/10.95 dxdgu2,dxdgd2,dxdgud,dcdgr2,dcdgu2,dcdgd2,dcdgud,dxdg2r ,dxdg2u,dxdg2d,dcdg2r, &[] [98] Underfull \hbox (badness 10000) in paragraph at lines 5521--5522 Overfull \hbox (6.55638pt too wide) in paragraph at lines 5524--5528 \OT1/cmtt/m/n/10.95 http://www.tddft.org/programs/octopus/wiki/index.php/Libxc\ OT1/cmr/m/n/10.95 . The sec-ond and third [99] Underfull \hbox (badness 10000) in paragraph at lines 5550--5551 Underfull \hbox (badness 10000) in paragraph at lines 5578--5579 [100] Underfull \hbox (badness 10000) in paragraph at lines 5614--5615 Underfull \hbox (badness 10000) in paragraph at lines 5655--5656 [101] Overfull \hbox (3.28027pt too wide) in paragraph at lines 5711--5711 [] \OT1/cmtt/m/n/10.95 nu : current output vector as well as the next input vector of the[] Underfull \hbox (badness 10000) in paragraph at lines 5712--5713 [102] Underfull \hbox (badness 10000) in paragraph at lines 5763--5764 Underfull \hbox (badness 10000) in paragraph at lines 5830--5831 [103] Overfull \hbox (9.02896pt too wide) in paragraph at lines 5887--5887 [] \OT1/cmtt/m/n/10.95 subroutine xcifc(xctype,n,c_tb09,tempa,rho,rhoup,rhodn,g rho,gup,gdn,g2rho, & Overfull \hbox (26.27502pt too wide) in paragraph at lines 5887--5887 [] \OT1/cmtt/m/n/10.95 g2up,g2dn,g3rho,g3up,g3dn,grho2,gup2,gdn2,gupdn,tau,tau up,taudn,ex,ec,vx,vc, &[] Overfull \hbox (26.27502pt too wide) in paragraph at lines 5887--5887 [] \OT1/cmtt/m/n/10.95 vxup,vxdn,vcup,vcdn,dxdgr2,dxdgu2,dxdgd2,dxdgud,dcdgr2, dcdgu2,dcdgd2,dcdgud, &[] [104] Underfull \hbox (badness 10000) in paragraph at lines 5939--5940 [105] Underfull \hbox (badness 10000) in paragraph at lines 5973--5974 Underfull \hbox (badness 10000) in paragraph at lines 6005--6006 [106] Underfull \hbox (badness 10000) in paragraph at lines 6028--6029 Underfull \hbox (badness 10000) in paragraph at lines 6059--6060 [107] Underfull \hbox (badness 10000) in paragraph at lines 6087--6088 Underfull \hbox (badness 10000) in paragraph at lines 6112--6113 Underfull \hbox (badness 10000) in paragraph at lines 6151--6152 [108] Underfull \hbox (badness 10000) in paragraph at lines 6217--6218 Underfull \hbox (badness 10000) in paragraph at lines 6247--6248 [109] Underfull \hbox (badness 10000) in paragraph at lines 6287--6288 [110] Underfull \hbox (badness 10000) in paragraph at lines 6361--6362 Underfull \hbox (badness 10000) in paragraph at lines 6389--6390 [111] Underfull \hbox (badness 10000) in paragraph at lines 6417--6418 Overfull \hbox (3.28027pt too wide) in paragraph at lines 6448--6448 [] \OT1/cmtt/m/n/10.95 vpl : connecting point vectors in lattice coordinat es (out,real(3,np))[] Underfull \hbox (badness 10000) in paragraph at lines 6449--6450 [112] Underfull \hbox (badness 10000) in paragraph at lines 6491--6492 Underfull \hbox (badness 10000) in paragraph at lines 6517--6518 [113] Underfull \hbox (badness 10000) in paragraph at lines 6548--6549 Overfull \hbox (0.21347pt too wide) in paragraph at lines 6551--6554 []\OT1/cmr/m/n/10.95 Computes the Kohn-Sham ef-fec-tive po-ten-tial by adding t o-gether the Coulomb and exchange- Underfull \hbox (badness 10000) in paragraph at lines 6580--6581 [114] Underfull \hbox (badness 10000) in paragraph at lines 6608--6609 Underfull \hbox (badness 10000) in paragraph at lines 6636--6637 [115] Underfull \hbox (badness 10000) in paragraph at lines 6666--6667 Overfull \hbox (26.27502pt too wide) in paragraph at lines 6690--6690 [] \OT1/cmtt/m/n/10.95 subroutine potxc(tsh,xctype_,rhomt_,rhoir_,magmt_,magir_ ,taumt_,tauir_,exmt_, & Underfull \hbox (badness 10000) in paragraph at lines 6693--6694 [116] Underfull \hbox (badness 10000) in paragraph at lines 6778--6779 Underfull \hbox (badness 10000) in paragraph at lines 6801--6802 Underfull \hbox (badness 10000) in paragraph at lines 6826--6827 [117] Underfull \hbox (badness 10000) in paragraph at lines 6849--6850 Underfull \hbox (badness 10000) in paragraph at lines 6873--6874 [118] Underfull \hbox (badness 10000) in paragraph at lines 6897--6898 Underfull \hbox (badness 10000) in paragraph at lines 6921--6922 Underfull \hbox (badness 10000) in paragraph at lines 6945--6946 [119] Underfull \hbox (badness 10000) in paragraph at lines 6969--6970 Underfull \hbox (badness 10000) in paragraph at lines 6995--6996 [120] Underfull \hbox (badness 10000) in paragraph at lines 7037--7038 [121] Underfull \hbox (badness 10000) in paragraph at lines 7076--7077 [122] Underfull \hbox (badness 10000) in paragraph at lines 7115--7116 Overfull \hbox (0.44627pt too wide) in paragraph at lines 7118--7120 []\OT1/cmr/m/n/10.95 Calculates the deriva-tive of the to-tal en-ergy w.r.t. th e second-variational co-ef-fi-cients \OT1/cmtt/m/n/10.95 evecsv\OT1/cmr/m/n/10. 95 . Underfull \hbox (badness 10000) in paragraph at lines 7141--7142 Underfull \hbox (badness 10000) in paragraph at lines 7166--7167 [123] Underfull \hbox (badness 10000) in paragraph at lines 7191--7192 Underfull \hbox (badness 10000) in paragraph at lines 7216--7217 [124] Underfull \hbox (badness 10000) in paragraph at lines 7241--7242 Underfull \hbox (badness 10000) in paragraph at lines 7267--7268 [125] Underfull \hbox (badness 10000) in paragraph at lines 7291--7292 Underfull \hbox (badness 10000) in paragraph at lines 7314--7315 Underfull \hbox (badness 10000) in paragraph at lines 7339--7340 [126] Underfull \hbox (badness 10000) in paragraph at lines 7365--7366 Underfull \hbox (badness 10000) in paragraph at lines 7389--7390 [127] Underfull \hbox (badness 10000) in paragraph at lines 7414--7415 Underfull \hbox (badness 10000) in paragraph at lines 7438--7439 Underfull \hbox (badness 10000) in paragraph at lines 7463--7464 [128] Underfull \hbox (badness 10000) in paragraph at lines 7494--7495 Overfull \hbox (5.17302pt too wide) in paragraph at lines 7497--7499 []\OT1/cmr/m/n/10.95 Writes the deriva-tive of to-tal en-ergy with re-spect to oc-cu-pa-tion num-bers to file \OT1/cmtt/m/n/10.95 RDM[]DEDN.OUT\OT1/cmr/m/n/10 .95 . Underfull \hbox (badness 10000) in paragraph at lines 7519--7520 [129] Underfull \hbox (badness 10000) in paragraph at lines 7577--7578 [130] Underfull \hbox (badness 10000) in paragraph at lines 7617--7618 Underfull \hbox (badness 10000) in paragraph at lines 7645--7646 Underfull \hbox (badness 10000) in paragraph at lines 7675--7676 [131] Overfull \hbox (3.28027pt too wide) in paragraph at lines 7719--7719 [] \OT1/cmtt/m/n/10.95 rfir1 : first real interstitial function in real-spa ce (in,real(ngtot))[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 7719--7719 [] \OT1/cmtt/m/n/10.95 rfmt2 : second function in real spherical harmonics for all muffin-tins[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 7719--7719 [] \OT1/cmtt/m/n/10.95 rfir2 : second real interstitial function in real-sp ace (in,real(ngtot))[] Underfull \hbox (badness 10000) in paragraph at lines 7720--7721 [132] Underfull \hbox (badness 10000) in paragraph at lines 7764--7765 Underfull \hbox (badness 10000) in paragraph at lines 7795--7796 [133] Overfull \hbox (9.02896pt too wide) in paragraph at lines 7828--7828 [] \OT1/cmtt/m/n/10.95 nri : number of radial mesh points on the inner pa rt of the muffin-tin[] Underfull \hbox (badness 10000) in paragraph at lines 7829--7830 Underfull \hbox (badness 10000) in paragraph at lines 7883--7884 [134] Underfull \hbox (badness 10000) in paragraph at lines 7909--7910 Overfull \hbox (9.02896pt too wide) in paragraph at lines 7947--7947 [] \OT1/cmtt/m/n/10.95 igpig : index from G+p-vectors to G-vectors (in,int eger(ngkmax,nspnfv))[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 7947--7947 [] \OT1/cmtt/m/n/10.95 evecfv : first-variational eigenvectors (in,complex( nmatmax,nstfv,nspnfv))[] Underfull \hbox (badness 10000) in paragraph at lines 7948--7949 [135] Underfull \hbox (badness 10000) in paragraph at lines 7983--7984 [136] Underfull \hbox (badness 10000) in paragraph at lines 8006--8007 Underfull \hbox (badness 10000) in paragraph at lines 8033--8034 Underfull \hbox (badness 10000) in paragraph at lines 8060--8061 [137] Underfull \hbox (badness 10000) in paragraph at lines 8112--8113 [138] Underfull \hbox (badness 10000) in paragraph at lines 8155--8156 [139] Underfull \hbox (badness 10000) in paragraph at lines 8211--8212 Overfull \hbox (14.77765pt too wide) in paragraph at lines 8249--8249 [] \OT1/cmtt/m/n/10.95 zflm1 : coefficients of the complex spherical harmon ic expansion for each[] Underfull \hbox (badness 10000) in paragraph at lines 8250--8251 [140] Underfull \hbox (badness 10000) in paragraph at lines 8288--8289 [141] Underfull \hbox (badness 10000) in paragraph at lines 8331--8332 [142] Underfull \hbox (badness 10000) in paragraph at lines 8368--8369 Underfull \hbox (badness 10000) in paragraph at lines 8402--8403 [143] Underfull \hbox (badness 10000) in paragraph at lines 8436--8437 [144] Underfull \hbox (badness 10000) in paragraph at lines 8475--8476 Underfull \hbox (badness 10000) in paragraph at lines 8510--8511 [145] Underfull \hbox (badness 10000) in paragraph at lines 8533--8534 Underfull \hbox (badness 10000) in paragraph at lines 8561--8562 [146] Underfull \hbox (badness 10000) in paragraph at lines 8592--8593 Underfull \hbox (badness 10000) in paragraph at lines 8623--8624 [147] Underfull \hbox (badness 10000) in paragraph at lines 8653--8654 Underfull \hbox (badness 10000) in paragraph at lines 8685--8686 [148] Underfull \hbox (badness 10000) in paragraph at lines 8711--8712 Underfull \hbox (badness 10000) in paragraph at lines 8743--8744 [149] Underfull \hbox (badness 10000) in paragraph at lines 8774--8775 Underfull \hbox (badness 10000) in paragraph at lines 8822--8823 [150] Underfull \hbox (badness 10000) in paragraph at lines 8847--8848 Underfull \hbox (badness 10000) in paragraph at lines 8875--8876 [151] Underfull \hbox (badness 10000) in paragraph at lines 8908--8909 Underfull \hbox (badness 10000) in paragraph at lines 8939--8940 [152] Overfull \hbox (3.28027pt too wide) in paragraph at lines 8989--8989 [] \OT1/cmtt/m/n/10.95 nri : number of radial points on the inner part (in ,integer(nspecies))[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 8989--8989 [] \OT1/cmtt/m/n/10.95 np : total number of points in each muffin-tin (in ,integer(nspecies))[] Underfull \hbox (badness 10000) in paragraph at lines 8990--8991 Underfull \hbox (badness 10000) in paragraph at lines 9019--9020 [153] Overfull \hbox (3.28027pt too wide) in paragraph at lines 9057--9057 [] \OT1/cmtt/m/n/10.95 nr : number of radial points for each species (in ,integer(nspecies))[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 9057--9057 [] \OT1/cmtt/m/n/10.95 nri : number of radial points on the inner part (i n,integer(nspecies))[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 9057--9057 [] \OT1/cmtt/m/n/10.95 np : total number of points in each muffin-tin (i n,integer(nspecies))[] Underfull \hbox (badness 10000) in paragraph at lines 9058--9059 [154] Underfull \hbox (badness 10000) in paragraph at lines 9094--9095 Overfull \hbox (26.27502pt too wide) in paragraph at lines 9125--9125 [] \OT1/cmtt/m/n/10.95 vca : vectors in Cartesian coordinates for all ato ms (in,real(3,natmtot)) Underfull \hbox (badness 10000) in paragraph at lines 9126--9127 Underfull \hbox (badness 10000) in paragraph at lines 9174--9175 [155] Underfull \hbox (badness 10000) in paragraph at lines 9226--9227 Underfull \hbox (badness 10000) in paragraph at lines 9249--9250 [156] Overfull \hbox (20.52634pt too wide) in paragraph at lines 9291--9291 [] \OT1/cmtt/m/n/10.95 apwalm : APW matching coefficients (in,complex(ngkma x,apwordmax,lmmaxapw))[] Underfull \hbox (badness 10000) in paragraph at lines 9292--9293 Underfull \hbox (badness 10000) in paragraph at lines 9340--9341 [157] Underfull \hbox (badness 10000) in paragraph at lines 9374--9375 Underfull \hbox (badness 10000) in paragraph at lines 9400--9401 [158] Underfull \hbox (badness 10000) in paragraph at lines 9465--9466 [159] Underfull \hbox (badness 10000) in paragraph at lines 9488--9489 Underfull \hbox (badness 10000) in paragraph at lines 9530--9531 [160] Underfull \hbox (badness 10000) in paragraph at lines 9565--9566 Underfull \hbox (badness 10000) in paragraph at lines 9603--9604 Underfull \hbox (badness 10000) in paragraph at lines 9629--9630 [161] Underfull \hbox (badness 10000) in paragraph at lines 9657--9658 Underfull \hbox (badness 10000) in paragraph at lines 9684--9685 [162] Underfull \hbox (badness 10000) in paragraph at lines 9708--9709 Underfull \hbox (badness 10000) in paragraph at lines 9739--9740 Overfull \hbox (16.14984pt too wide) in paragraph at lines 9742--9744 []\OT1/cmr/m/n/10.95 Writes the lin-eari-sa-tion en-er-gies for all APW and loc al-orbital func-tions to the file \OT1/cmtt/m/n/10.95 LINENGY.OUT\OT1/cmr/m/n/1 0.95 . [163] Underfull \hbox (badness 10000) in paragraph at lines 9771--9772 Underfull \hbox (badness 10000) in paragraph at lines 9807--9808 Underfull \hbox (badness 10000) in paragraph at lines 9839--9840 [164] Underfull \hbox (badness 10000) in paragraph at lines 9878--9879 Underfull \hbox (badness 10000) in paragraph at lines 9903--9904 [165] Underfull \hbox (badness 10000) in paragraph at lines 9932--9933 Underfull \hbox (badness 10000) in paragraph at lines 9957--9958 [166] Underfull \hbox (badness 10000) in paragraph at lines 10005--10006 Underfull \hbox (badness 10000) in paragraph at lines 10031--10032 [167] Underfull \hbox (badness 10000) in paragraph at lines 10052--10053 Underfull \hbox (badness 10000) in paragraph at lines 10072--10073 Underfull \hbox (badness 10000) in paragraph at lines 10094--10095 [168] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10122--10122 [] \OT1/cmtt/m/n/10.95 subroutine xc_pbe(n,kappa,mu,beta,rhoup,rhodn,grho,gup,g dn,g2up,g2dn,g3rho, & Underfull \hbox (badness 10000) in paragraph at lines 10143--10144 [169] Underfull \hbox (badness 10000) in paragraph at lines 10179--10180 Underfull \hbox (badness 10000) in paragraph at lines 10209--10210 [170] Underfull \hbox (badness 10000) in paragraph at lines 10242--10243 [171] Underfull \hbox (badness 10000) in paragraph at lines 10274--10275 Underfull \hbox (badness 10000) in paragraph at lines 10301--10302 [172] Overfull \hbox (3.28027pt too wide) in paragraph at lines 10333--10333 [] \OT1/cmtt/m/n/10.95 dy : rotation matrix for complex spherical harmoni cs (out,real(ld,*))[] Underfull \hbox (badness 10000) in paragraph at lines 10334--10335 Underfull \hbox (badness 10000) in paragraph at lines 10367--10368 [173] Underfull \hbox (badness 10000) in paragraph at lines 10392--10393 Underfull \hbox (badness 10000) in paragraph at lines 10417--10418 Underfull \hbox (badness 10000) in paragraph at lines 10442--10443 [174] Underfull \hbox (badness 10000) in paragraph at lines 10473--10474 [175] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10509--10509 [] \OT1/cmtt/m/n/10.95 nri : number of points on the inner part of the mu ffin-tin (in,integer)[] Underfull \hbox (badness 10000) in paragraph at lines 10510--10511 Overfull \hbox (14.77765pt too wide) in paragraph at lines 10546--10546 [] \OT1/cmtt/m/n/10.95 zfmt1 : first complex function in spherical harmonic s/coordinates for all Overfull \hbox (20.52634pt too wide) in paragraph at lines 10546--10546 [] \OT1/cmtt/m/n/10.95 zfmt2 : second complex function in spherical harmoni cs/coordinates for all[] [176] Underfull \hbox (badness 10000) in paragraph at lines 10547--10548 Underfull \hbox (badness 10000) in paragraph at lines 10577--10578 [177] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10622--10622 [] \OT1/cmtt/m/n/10.95 nri : number of points on the inner part of the mu ffin-tin (in,integer)[] Underfull \hbox (badness 10000) in paragraph at lines 10623--10624 Overfull \hbox (14.77765pt too wide) in paragraph at lines 10674--10674 [] \OT1/cmtt/m/n/10.95 nri : number of points on the inner part of the mu ffin-tin (in,integer)[] [178] Underfull \hbox (badness 10000) in paragraph at lines 10675--10676 Underfull \hbox (badness 10000) in paragraph at lines 10706--10707 [179] Underfull \hbox (badness 10000) in paragraph at lines 10755--10756 Overfull \hbox (14.77765pt too wide) in paragraph at lines 10782--10782 [] \OT1/cmtt/m/n/10.95 subroutine zpotcoul(nr,nri,np,npi,ld1,r,ngdg,igf,ngp,gpc ,gclgp,ld2,jlgprmt, & Overfull \hbox (14.77765pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 nr : number of radial points for each species ( in,integer(nspecies)) [180] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 jlgprmt : spherical Bessel functions for evergy G+p- vector and muffin-tin[] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 ylmgp : spherical harmonics of the G+p-vectors (in ,complex(lmmaxo,ngp))[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 sfacgp : structure factors of the G+p-vectors (in,c omplex(ld2,natmtot))[] Underfull \hbox (badness 10000) in paragraph at lines 10807--10808 [181] Underfull \hbox (badness 10000) in paragraph at lines 10888--10889 [182] Underfull \hbox (badness 10000) in paragraph at lines 10923--10924 [183] (./elk.aux) LaTeX Warning: Label(s) may have changed. Rerun to get cross-references right. ) (see the transcript file for additional information) Output written on elk.pdf (183 pages, 676320 bytes). Transcript written on elk.log. This is pdfTeX, Version 3.14159265-2.6-1.40.19 (TeX Live 2019/dev/Debian) (preloaded format=pdflatex) restricted \write18 enabled. entering extended mode (./elk.tex LaTeX2e <2018-12-01> (/usr/share/texlive/texmf-dist/tex/latex/base/article.cls Document Class: article 2018/09/03 v1.4i Standard LaTeX document class (/usr/share/texlive/texmf-dist/tex/latex/base/size11.clo)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsmath.sty For additional information on amsmath, use the `?' option. (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amstext.sty (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsgen.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsbsy.sty) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsopn.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amssymb.sty (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amsfonts.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/epsfig.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphicx.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/keyval.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphics.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/trig.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics-cfg/graphics.cfg) (/usr/share/texlive/texmf-dist/tex/latex/graphics-def/pdftex.def)))) (/usr/share/texlive/texmf-dist/tex/latex/tools/tabularx.sty (/usr/share/texlive/texmf-dist/tex/latex/tools/array.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/color.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics-cfg/color.cfg)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/hyperref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/hobsub-hyperref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/hobsub-generic.sty)) (/usr/share/texlive/texmf-dist/tex/generic/ifxetex/ifxetex.sty) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/auxhook.sty) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/kvoptions.sty) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/pd1enc.def) (/usr/share/texlive/texmf-dist/tex/latex/latexconfig/hyperref.cfg) (/usr/share/texlive/texmf-dist/tex/latex/url/url.sty)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/hpdftex.def (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/rerunfilecheck.sty)) (./elk.aux) (/usr/share/texlive/texmf-dist/tex/context/base/mkii/supp-pdf.mkii [Loading MPS to PDF converter (version 2006.09.02).] ) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/epstopdf-base.sty (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/grfext.sty) (/usr/share/texlive/texmf-dist/tex/latex/latexconfig/epstopdf-sys.cfg)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/nameref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/gettitlestring.sty)) (./elk.out) (./elk.out) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsa.fd) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsb.fd) Overfull \hbox (17.24997pt too wide) in paragraph at lines 77--79 [][][][] Underfull \hbox (badness 10000) in paragraph at lines 77--79 [1{/var/lib/texmf/fonts/map/pdftex/updmap/pdftex.map} <./elk_silhouette.pdf>] (./elk.toc [2] [3] [4] [5] [6] [7] [8] [9]) [10] [11] [12] [13] Overfull \hbox (14.77765pt too wide) in paragraph at lines 296--296 [] \OT1/cmtt/m/n/10.95 1 0 1 2.00000 T : nsp, ls p, ksp, occsp, spcore[] [14] [15] [16] [17] [18] [19] [20] [21] Overfull \hbox (0.95221pt too wide) in paragraph at lines 655--659 []\OT1/cmr/m/n/10.95 If \OT1/cmtt/m/n/10.95 fracinr \OT1/cmr/m/n/10.95 is neg-a -tive then the frac-tion is de-ter-mined from $\OML/cmm/m/it/10.95 f \OT1/cmr/m /n/10.95 = []$ [22] [23] [24] [25] [26] [27] [28] [29] [30] [31] [32] [33] [34] [35] [36] [37] [38] [39] [40] (/usr/share/texlive/texmf-dist/tex/latex/base/omscmr.fd) [41] [42] Underfull \hbox (badness 10000) in paragraph at lines 1652--1653 Overfull \hbox (26.27502pt too wide) in paragraph at lines 1684--1684 [] \OT1/cmtt/m/n/10.95 subroutine atom(sol,ptnucl,zn,nst,n,l,k,occ,xctype,xcgra d,nr,r,eval,rho,vr,rwf) Overfull \hbox (26.27502pt too wide) in paragraph at lines 1702--1702 [] \OT1/cmtt/m/n/10.95 eval : eigenvalue without rest-mass energy for eac h state (out,real(nst))[] [43] Overfull \hbox (20.52634pt too wide) in paragraph at lines 1702--1702 [] \OT1/cmtt/m/n/10.95 rwf : major and minor components of radial wavefu nctions for each state[] Underfull \hbox (badness 10000) in paragraph at lines 1703--1704 Underfull \hbox (badness 10000) in paragraph at lines 1731--1732 [44] Underfull \hbox (badness 10000) in paragraph at lines 1763--1764 Underfull \hbox (badness 10000) in paragraph at lines 1789--1790 Underfull \hbox (badness 10000) in paragraph at lines 1816--1817 [45] Underfull \hbox (badness 10000) in paragraph at lines 1864--1865 [46] Underfull \hbox (badness 10000) in paragraph at lines 1906--1907 Underfull \hbox (badness 10000) in paragraph at lines 1939--1940 [47] Underfull \hbox (badness 10000) in paragraph at lines 1966--1967 Underfull \hbox (badness 10000) in paragraph at lines 2011--2012 Underfull \hbox (badness 10000) in paragraph at lines 2068--2069 [48] Overfull \hbox (20.52634pt too wide) in paragraph at lines 2137--2137 [] \OT1/cmtt/m/n/10.95 tocc : .true. if just the occupied orbitals should contribute to the DOS[] Underfull \hbox (badness 10000) in paragraph at lines 2138--2139 [49] Underfull \hbox (badness 10000) in paragraph at lines 2231--2232 Underfull \hbox (badness 10000) in paragraph at lines 2272--2273 [50] Underfull \hbox (badness 10000) in paragraph at lines 2319--2320 [51] Underfull \hbox (badness 10000) in paragraph at lines 2386--2387 [52] Underfull \hbox (badness 10000) in paragraph at lines 2426--2427 Underfull \hbox (badness 10000) in paragraph at lines 2451--2452 Underfull \hbox (badness 10000) in paragraph at lines 2482--2483 [53] Underfull \hbox (badness 10000) in paragraph at lines 2515--2516 [54] Overfull \hbox (3.28027pt too wide) in paragraph at lines 2546--2546 [] \OT1/cmtt/m/n/10.95 h,o : Hamiltonian and overlap matrices in packed or upper triangular[] Underfull \hbox (badness 10000) in paragraph at lines 2547--2548 Underfull \hbox (badness 10000) in paragraph at lines 2608--2609 [55] Underfull \hbox (badness 10000) in paragraph at lines 2634--2635 Underfull \hbox (badness 10000) in paragraph at lines 2661--2662 [56] Overfull \hbox (32.02371pt too wide) in paragraph at lines 2704--2704 [] \OT1/cmtt/m/n/10.95 demax : maximum allowed change from the input energy ; enforced only if e < 0[] Underfull \hbox (badness 10000) in paragraph at lines 2705--2706 Underfull \hbox (badness 10000) in paragraph at lines 2744--2745 [57] Overfull \hbox (20.52634pt too wide) in paragraph at lines 2779--2779 [] \OT1/cmtt/m/n/10.95 nspnfv : number of first-variational spin components : 1 normal case, 2 for[] Underfull \hbox (badness 10000) in paragraph at lines 2780--2781 Underfull \hbox (badness 10000) in paragraph at lines 2810--2811 [58] Underfull \hbox (badness 10000) in paragraph at lines 2844--2845 [59] Overfull \hbox (9.02896pt too wide) in paragraph at lines 2885--2885 [] \OT1/cmtt/m/n/10.95 lspl : spatial rotation element in lattice point gro up for each symmetry[] Underfull \hbox (badness 10000) in paragraph at lines 2886--2887 Underfull \hbox (badness 10000) in paragraph at lines 2918--2919 [60] Underfull \hbox (badness 10000) in paragraph at lines 2954--2955 Underfull \hbox (badness 10000) in paragraph at lines 2994--2995 [61] [62] Underfull \hbox (badness 10000) in paragraph at lines 3076--3077 Underfull \hbox (badness 10000) in paragraph at lines 3100--3101 [63] Underfull \hbox (badness 10000) in paragraph at lines 3131--3132 Underfull \hbox (badness 10000) in paragraph at lines 3167--3168 [64] Underfull \hbox (badness 10000) in paragraph at lines 3196--3197 Underfull \hbox (badness 10000) in paragraph at lines 3221--3222 [65] Underfull \hbox (badness 10000) in paragraph at lines 3250--3251 Underfull \hbox (badness 10000) in paragraph at lines 3276--3277 Underfull \hbox (badness 10000) in paragraph at lines 3300--3301 [66] Underfull \hbox (badness 10000) in paragraph at lines 3333--3334 [67] Underfull \hbox (badness 10000) in paragraph at lines 3376--3377 Underfull \hbox (badness 10000) in paragraph at lines 3411--3412 [68] Underfull \hbox (badness 10000) in paragraph at lines 3492--3493 Underfull \hbox (badness 10000) in paragraph at lines 3518--3519 [69] Underfull \hbox (badness 10000) in paragraph at lines 3562--3563 Overfull \hbox (3.28027pt too wide) in paragraph at lines 3605--3605 [] \OT1/cmtt/m/n/10.95 subroutine gengkvec(ngvec,ivg,vgc,vkl,vkc,gkmax,ngkmax,n gk,igkig,vgkl,vgkc) [70] Underfull \hbox (badness 10000) in paragraph at lines 3617--3618 Underfull \hbox (badness 10000) in paragraph at lines 3654--3655 [71] Underfull \hbox (badness 10000) in paragraph at lines 3698--3699 Underfull \hbox (badness 10000) in paragraph at lines 3731--3732 [72] Overfull \hbox (26.27502pt too wide) in paragraph at lines 3760--3760 [] \OT1/cmtt/m/n/10.95 first-variational basis; second-variational otherwise (in,logical)[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 3760--3760 [] \OT1/cmtt/m/n/10.95 tvclvr : .true. if the non-local Coulomb potential f rom the core states is[] Underfull \hbox (badness 10000) in paragraph at lines 3761--3762 Underfull \hbox (badness 10000) in paragraph at lines 3788--3789 [73] Overfull \hbox (3.28027pt too wide) in paragraph at lines 3833--3833 [] \OT1/cmtt/m/n/10.95 igpig : index from G+p-vectors to G-vectors (in,inte ger(ngkmax,nspnfv))[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 3833--3833 [] \OT1/cmtt/m/n/10.95 vgpc : G+p-vectors in Cartesian coordinates (in,rea l(3,ngkmax,nspnfv))[] Underfull \hbox (badness 10000) in paragraph at lines 3834--3835 Overfull \hbox (14.77765pt too wide) in paragraph at lines 3864--3864 [] \OT1/cmtt/m/n/10.95 subroutine genppts(tfbz,nsym,sym,ngridp,npptnr,epslat,bv ec,boxl,nppt,ipvip, & Overfull \hbox (32.02371pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 tfbz : .true. if vpl and vpc should be mapped to the first Brillouin zone Overfull \hbox (26.27502pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 nsym : number of point group symmetries used for reduction, set to 1 for[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 npptnr : number of non-reduced p-points: ngridp(1)* ngridp(2)*ngridp(3)[] [74] Overfull \hbox (9.02896pt too wide) in paragraph at lines 3890--3890 [] \OT1/cmtt/m/n/10.95 boxl : corners of box containing p-points in latt ice coordinates, the[] Underfull \hbox (badness 10000) in paragraph at lines 3891--3892 [75] Underfull \hbox (badness 10000) in paragraph at lines 3933--3934 Underfull \hbox (badness 10000) in paragraph at lines 3968--3969 [76] Underfull \hbox (badness 10000) in paragraph at lines 4002--4003 Underfull \hbox (badness 10000) in paragraph at lines 4029--4030 [77] Underfull \hbox (badness 10000) in paragraph at lines 4053--4054 Overfull \hbox (26.27502pt too wide) in paragraph at lines 4093--4093 [] \OT1/cmtt/m/n/10.95 jlgqr : spherical Bessel functions evaluated on the coarse radial mesh for[] Overfull \hbox (14.77765pt too wide) in paragraph at lines 4093--4093 [] \OT1/cmtt/m/n/10.95 ylmgq : spherical harmonics of the G+q-vectors (in, complex(lmmaxo,ngrf))[] Underfull \hbox (badness 10000) in paragraph at lines 4094--4095 [78] Underfull \hbox (badness 10000) in paragraph at lines 4196--4197 [79] Overfull \hbox (3.28027pt too wide) in paragraph at lines 4219--4219 [] \OT1/cmtt/m/n/10.95 vclijjk : Coulomb matrix elements (out,complex(nstsv ,nstsv,nstsv,nkpt))[] Underfull \hbox (badness 10000) in paragraph at lines 4220--4221 Underfull \hbox (badness 10000) in paragraph at lines 4248--4249 [80] Underfull \hbox (badness 10000) in paragraph at lines 4289--4290 Underfull \hbox (badness 10000) in paragraph at lines 4317--4318 Overfull \hbox (14.77765pt too wide) in paragraph at lines 4344--4344 [] \OT1/cmtt/m/n/10.95 subroutine genwfsv(tsh,tgp,nst,idx,ngdg,igf,ngp,igpig,ap walm,evecfv,evecsv, & Overfull \hbox (20.52634pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 tsh : .true. if wfmt should be in spherical harmo nic basis (in,logical) Overfull \hbox (3.28027pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 tgp : .true. if wfir should be in G+p-space, othe rwise in real-space[] [81] Overfull \hbox (9.02896pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 igpig : index from G+p-vectors to G-vectors (in,int eger(ngkmax,nspnfv))[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 evecfv : first-variational eigenvectors (in,complex( nmatmax,nstfv,nspnfv))[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 4364--4364 [] \OT1/cmtt/m/n/10.95 wfmt : muffin-tin part of the wavefunctions for ev ery state in spherical[] Underfull \hbox (badness 10000) in paragraph at lines 4365--4366 Underfull \hbox (badness 10000) in paragraph at lines 4402--4403 [82] Underfull \hbox (badness 10000) in paragraph at lines 4430--4431 Overfull \hbox (14.77765pt too wide) in paragraph at lines 4469--4469 [] \OT1/cmtt/m/n/10.95 tsh : .true. if the muffin-tin density is to be i n spherical harmonics Overfull \hbox (20.52634pt too wide) in paragraph at lines 4469--4469 [] \OT1/cmtt/m/n/10.95 tspc : .true. if the density should be contracted over spin (in,logical)[] [83] Underfull \hbox (badness 10000) in paragraph at lines 4470--4471 Overfull \hbox (3.28027pt too wide) in paragraph at lines 4537--4537 [] \OT1/cmtt/m/n/10.95 vgpl : G+p-vectors in lattice coordinates (out,rea l(3,ngkmax,nspnfv))[] Overfull \hbox (26.27502pt too wide) in paragraph at lines 4537--4537 [] \OT1/cmtt/m/n/10.95 evecfv : first-variational eigenvectors (out,complex (nmatmax,nstfv,nspnfv))[] Underfull \hbox (badness 10000) in paragraph at lines 4538--4539 [84] Underfull \hbox (badness 10000) in paragraph at lines 4582--4583 Overfull \hbox (3.28027pt too wide) in paragraph at lines 4606--4606 [] \OT1/cmtt/m/n/10.95 vclijjk : Coulomb matrix elements (out,complex(nstsv ,nstsv,nstsv,nkpt))[] Underfull \hbox (badness 10000) in paragraph at lines 4607--4608 Underfull \hbox (badness 10000) in paragraph at lines 4634--4635 [85] Underfull \hbox (badness 10000) in paragraph at lines 4656--4657 Underfull \hbox (badness 10000) in paragraph at lines 4678--4679 [86] Underfull \hbox (badness 10000) in paragraph at lines 4709--4710 Underfull \hbox (badness 10000) in paragraph at lines 4739--4740 Overfull \hbox (26.27502pt too wide) in paragraph at lines 4765--4765 [] \OT1/cmtt/m/n/10.95 subroutine ggair_sp_2b(g2up,g2dn,gvup,gvdn,vxup,vxdn,vcu p,vcdn,dxdgu2,dxdgd2, & [87] Underfull \hbox (badness 10000) in paragraph at lines 4767--4768 Underfull \hbox (badness 10000) in paragraph at lines 4790--4791 Underfull \hbox (badness 10000) in paragraph at lines 4812--4813 [88] Underfull \hbox (badness 10000) in paragraph at lines 4834--4835 Overfull \hbox (9.02896pt too wide) in paragraph at lines 4854--4854 [] \OT1/cmtt/m/n/10.95 subroutine ggamt_sp_1(is,rhoup,rhodn,grho,gup,gdn,g2up,g 2dn,g3rho,g3up,g3dn) Underfull \hbox (badness 10000) in paragraph at lines 4867--4868 [89] Underfull \hbox (badness 10000) in paragraph at lines 4898--4899 Overfull \hbox (3.28027pt too wide) in paragraph at lines 4954--4954 [] \OT1/cmtt/m/n/10.95 subroutine ggamt_sp_2b(is,g2up,g2dn,gvup,gvdn,vxup,vxdn, vcup,vcdn,dxdgu2, & Underfull \hbox (badness 10000) in paragraph at lines 4956--4957 [90] Underfull \hbox (badness 10000) in paragraph at lines 4983--4984 [91] Underfull \hbox (badness 10000) in paragraph at lines 5025--5026 Underfull \hbox (badness 10000) in paragraph at lines 5075--5076 [92] Underfull \hbox (badness 10000) in paragraph at lines 5120--5121 [93] Underfull \hbox (badness 10000) in paragraph at lines 5152--5153 Overfull \hbox (20.52634pt too wide) in paragraph at lines 5185--5185 [] \OT1/cmtt/m/n/10.95 apwalm : APW matching coefficients (in,complex(ngkma x,apwordmax,lmmaxapw))[] Underfull \hbox (badness 10000) in paragraph at lines 5186--5187 [94] Underfull \hbox (badness 10000) in paragraph at lines 5238--5239 Underfull \hbox (badness 10000) in paragraph at lines 5270--5271 [95] Underfull \hbox (badness 10000) in paragraph at lines 5316--5317 Underfull \hbox (badness 10000) in paragraph at lines 5339--5340 [96] Underfull \hbox (badness 10000) in paragraph at lines 5363--5364 Underfull \hbox (badness 10000) in paragraph at lines 5394--5395 [97] Underfull \hbox (badness 10000) in paragraph at lines 5423--5424 Overfull \hbox (26.27502pt too wide) in paragraph at lines 5475--5475 [] \OT1/cmtt/m/n/10.95 subroutine xcifc_libxc(xctype,n,c_tb09,tempa,rho,rhoup,r hodn,g2rho,g2up,g2dn, & Overfull \hbox (32.02371pt too wide) in paragraph at lines 5475--5475 [] \OT1/cmtt/m/n/10.95 grho2,gup2,gdn2,gupdn,tau,tauup,taudn,ex,ec,vx,vc,vxup, vxdn,vcup,vcdn,dxdgr2, &[] Overfull \hbox (32.02371pt too wide) in paragraph at lines 5475--5475 [] \OT1/cmtt/m/n/10.95 dxdgu2,dxdgd2,dxdgud,dcdgr2,dcdgu2,dcdgd2,dcdgud,dxdg2r ,dxdg2u,dxdg2d,dcdg2r, &[] [98] Underfull \hbox (badness 10000) in paragraph at lines 5521--5522 Overfull \hbox (6.55638pt too wide) in paragraph at lines 5524--5528 \OT1/cmtt/m/n/10.95 http://www.tddft.org/programs/octopus/wiki/index.php/Libxc\ OT1/cmr/m/n/10.95 . The sec-ond and third [99] Underfull \hbox (badness 10000) in paragraph at lines 5550--5551 Underfull \hbox (badness 10000) in paragraph at lines 5578--5579 [100] Underfull \hbox (badness 10000) in paragraph at lines 5614--5615 Underfull \hbox (badness 10000) in paragraph at lines 5655--5656 [101] Overfull \hbox (3.28027pt too wide) in paragraph at lines 5711--5711 [] \OT1/cmtt/m/n/10.95 nu : current output vector as well as the next input vector of the[] Underfull \hbox (badness 10000) in paragraph at lines 5712--5713 [102] Underfull \hbox (badness 10000) in paragraph at lines 5763--5764 Underfull \hbox (badness 10000) in paragraph at lines 5830--5831 [103] Overfull \hbox (9.02896pt too wide) in paragraph at lines 5887--5887 [] \OT1/cmtt/m/n/10.95 subroutine xcifc(xctype,n,c_tb09,tempa,rho,rhoup,rhodn,g rho,gup,gdn,g2rho, & Overfull \hbox (26.27502pt too wide) in paragraph at lines 5887--5887 [] \OT1/cmtt/m/n/10.95 g2up,g2dn,g3rho,g3up,g3dn,grho2,gup2,gdn2,gupdn,tau,tau up,taudn,ex,ec,vx,vc, &[] Overfull \hbox (26.27502pt too wide) in paragraph at lines 5887--5887 [] \OT1/cmtt/m/n/10.95 vxup,vxdn,vcup,vcdn,dxdgr2,dxdgu2,dxdgd2,dxdgud,dcdgr2, dcdgu2,dcdgd2,dcdgud, &[] [104] Underfull \hbox (badness 10000) in paragraph at lines 5939--5940 [105] Underfull \hbox (badness 10000) in paragraph at lines 5973--5974 Underfull \hbox (badness 10000) in paragraph at lines 6005--6006 [106] Underfull \hbox (badness 10000) in paragraph at lines 6028--6029 Underfull \hbox (badness 10000) in paragraph at lines 6059--6060 [107] Underfull \hbox (badness 10000) in paragraph at lines 6087--6088 Underfull \hbox (badness 10000) in paragraph at lines 6112--6113 Underfull \hbox (badness 10000) in paragraph at lines 6151--6152 [108] Underfull \hbox (badness 10000) in paragraph at lines 6217--6218 Underfull \hbox (badness 10000) in paragraph at lines 6247--6248 [109] Underfull \hbox (badness 10000) in paragraph at lines 6287--6288 [110] Underfull \hbox (badness 10000) in paragraph at lines 6361--6362 Underfull \hbox (badness 10000) in paragraph at lines 6389--6390 [111] Underfull \hbox (badness 10000) in paragraph at lines 6417--6418 Overfull \hbox (3.28027pt too wide) in paragraph at lines 6448--6448 [] \OT1/cmtt/m/n/10.95 vpl : connecting point vectors in lattice coordinat es (out,real(3,np))[] Underfull \hbox (badness 10000) in paragraph at lines 6449--6450 [112] Underfull \hbox (badness 10000) in paragraph at lines 6491--6492 Underfull \hbox (badness 10000) in paragraph at lines 6517--6518 [113] Underfull \hbox (badness 10000) in paragraph at lines 6548--6549 Overfull \hbox (0.21347pt too wide) in paragraph at lines 6551--6554 []\OT1/cmr/m/n/10.95 Computes the Kohn-Sham ef-fec-tive po-ten-tial by adding t o-gether the Coulomb and exchange- Underfull \hbox (badness 10000) in paragraph at lines 6580--6581 [114] Underfull \hbox (badness 10000) in paragraph at lines 6608--6609 Underfull \hbox (badness 10000) in paragraph at lines 6636--6637 [115] Underfull \hbox (badness 10000) in paragraph at lines 6666--6667 Overfull \hbox (26.27502pt too wide) in paragraph at lines 6690--6690 [] \OT1/cmtt/m/n/10.95 subroutine potxc(tsh,xctype_,rhomt_,rhoir_,magmt_,magir_ ,taumt_,tauir_,exmt_, & Underfull \hbox (badness 10000) in paragraph at lines 6693--6694 [116] Underfull \hbox (badness 10000) in paragraph at lines 6778--6779 Underfull \hbox (badness 10000) in paragraph at lines 6801--6802 Underfull \hbox (badness 10000) in paragraph at lines 6826--6827 [117] Underfull \hbox (badness 10000) in paragraph at lines 6849--6850 Underfull \hbox (badness 10000) in paragraph at lines 6873--6874 [118] Underfull \hbox (badness 10000) in paragraph at lines 6897--6898 Underfull \hbox (badness 10000) in paragraph at lines 6921--6922 Underfull \hbox (badness 10000) in paragraph at lines 6945--6946 [119] Underfull \hbox (badness 10000) in paragraph at lines 6969--6970 Underfull \hbox (badness 10000) in paragraph at lines 6995--6996 [120] Underfull \hbox (badness 10000) in paragraph at lines 7037--7038 [121] Underfull \hbox (badness 10000) in paragraph at lines 7076--7077 [122] Underfull \hbox (badness 10000) in paragraph at lines 7115--7116 Overfull \hbox (0.44627pt too wide) in paragraph at lines 7118--7120 []\OT1/cmr/m/n/10.95 Calculates the deriva-tive of the to-tal en-ergy w.r.t. th e second-variational co-ef-fi-cients \OT1/cmtt/m/n/10.95 evecsv\OT1/cmr/m/n/10. 95 . Underfull \hbox (badness 10000) in paragraph at lines 7141--7142 Underfull \hbox (badness 10000) in paragraph at lines 7166--7167 [123] Underfull \hbox (badness 10000) in paragraph at lines 7191--7192 Underfull \hbox (badness 10000) in paragraph at lines 7216--7217 [124] Underfull \hbox (badness 10000) in paragraph at lines 7241--7242 Underfull \hbox (badness 10000) in paragraph at lines 7267--7268 [125] Underfull \hbox (badness 10000) in paragraph at lines 7291--7292 Underfull \hbox (badness 10000) in paragraph at lines 7314--7315 Underfull \hbox (badness 10000) in paragraph at lines 7339--7340 [126] Underfull \hbox (badness 10000) in paragraph at lines 7365--7366 Underfull \hbox (badness 10000) in paragraph at lines 7389--7390 [127] Underfull \hbox (badness 10000) in paragraph at lines 7414--7415 Underfull \hbox (badness 10000) in paragraph at lines 7438--7439 Underfull \hbox (badness 10000) in paragraph at lines 7463--7464 [128] Underfull \hbox (badness 10000) in paragraph at lines 7494--7495 Overfull \hbox (5.17302pt too wide) in paragraph at lines 7497--7499 []\OT1/cmr/m/n/10.95 Writes the deriva-tive of to-tal en-ergy with re-spect to oc-cu-pa-tion num-bers to file \OT1/cmtt/m/n/10.95 RDM[]DEDN.OUT\OT1/cmr/m/n/10 .95 . Underfull \hbox (badness 10000) in paragraph at lines 7519--7520 [129] Underfull \hbox (badness 10000) in paragraph at lines 7577--7578 [130] Underfull \hbox (badness 10000) in paragraph at lines 7617--7618 Underfull \hbox (badness 10000) in paragraph at lines 7645--7646 Underfull \hbox (badness 10000) in paragraph at lines 7675--7676 [131] Overfull \hbox (3.28027pt too wide) in paragraph at lines 7719--7719 [] \OT1/cmtt/m/n/10.95 rfir1 : first real interstitial function in real-spa ce (in,real(ngtot))[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 7719--7719 [] \OT1/cmtt/m/n/10.95 rfmt2 : second function in real spherical harmonics for all muffin-tins[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 7719--7719 [] \OT1/cmtt/m/n/10.95 rfir2 : second real interstitial function in real-sp ace (in,real(ngtot))[] Underfull \hbox (badness 10000) in paragraph at lines 7720--7721 [132] Underfull \hbox (badness 10000) in paragraph at lines 7764--7765 Underfull \hbox (badness 10000) in paragraph at lines 7795--7796 [133] Overfull \hbox (9.02896pt too wide) in paragraph at lines 7828--7828 [] \OT1/cmtt/m/n/10.95 nri : number of radial mesh points on the inner pa rt of the muffin-tin[] Underfull \hbox (badness 10000) in paragraph at lines 7829--7830 Underfull \hbox (badness 10000) in paragraph at lines 7883--7884 [134] Underfull \hbox (badness 10000) in paragraph at lines 7909--7910 Overfull \hbox (9.02896pt too wide) in paragraph at lines 7947--7947 [] \OT1/cmtt/m/n/10.95 igpig : index from G+p-vectors to G-vectors (in,int eger(ngkmax,nspnfv))[] Overfull \hbox (20.52634pt too wide) in paragraph at lines 7947--7947 [] \OT1/cmtt/m/n/10.95 evecfv : first-variational eigenvectors (in,complex( nmatmax,nstfv,nspnfv))[] Underfull \hbox (badness 10000) in paragraph at lines 7948--7949 [135] Underfull \hbox (badness 10000) in paragraph at lines 7983--7984 [136] Underfull \hbox (badness 10000) in paragraph at lines 8006--8007 Underfull \hbox (badness 10000) in paragraph at lines 8033--8034 Underfull \hbox (badness 10000) in paragraph at lines 8060--8061 [137] Underfull \hbox (badness 10000) in paragraph at lines 8112--8113 [138] Underfull \hbox (badness 10000) in paragraph at lines 8155--8156 [139] Underfull \hbox (badness 10000) in paragraph at lines 8211--8212 Overfull \hbox (14.77765pt too wide) in paragraph at lines 8249--8249 [] \OT1/cmtt/m/n/10.95 zflm1 : coefficients of the complex spherical harmon ic expansion for each[] Underfull \hbox (badness 10000) in paragraph at lines 8250--8251 [140] Underfull \hbox (badness 10000) in paragraph at lines 8288--8289 [141] Underfull \hbox (badness 10000) in paragraph at lines 8331--8332 [142] Underfull \hbox (badness 10000) in paragraph at lines 8368--8369 Underfull \hbox (badness 10000) in paragraph at lines 8402--8403 [143] Underfull \hbox (badness 10000) in paragraph at lines 8436--8437 [144] Underfull \hbox (badness 10000) in paragraph at lines 8475--8476 Underfull \hbox (badness 10000) in paragraph at lines 8510--8511 [145] Underfull \hbox (badness 10000) in paragraph at lines 8533--8534 Underfull \hbox (badness 10000) in paragraph at lines 8561--8562 [146] Underfull \hbox (badness 10000) in paragraph at lines 8592--8593 Underfull \hbox (badness 10000) in paragraph at lines 8623--8624 [147] Underfull \hbox (badness 10000) in paragraph at lines 8653--8654 Underfull \hbox (badness 10000) in paragraph at lines 8685--8686 [148] Underfull \hbox (badness 10000) in paragraph at lines 8711--8712 Underfull \hbox (badness 10000) in paragraph at lines 8743--8744 [149] Underfull \hbox (badness 10000) in paragraph at lines 8774--8775 Underfull \hbox (badness 10000) in paragraph at lines 8822--8823 [150] Underfull \hbox (badness 10000) in paragraph at lines 8847--8848 Underfull \hbox (badness 10000) in paragraph at lines 8875--8876 [151] Underfull \hbox (badness 10000) in paragraph at lines 8908--8909 Underfull \hbox (badness 10000) in paragraph at lines 8939--8940 [152] Overfull \hbox (3.28027pt too wide) in paragraph at lines 8989--8989 [] \OT1/cmtt/m/n/10.95 nri : number of radial points on the inner part (in ,integer(nspecies))[] Overfull \hbox (3.28027pt too wide) in paragraph at lines 8989--8989 [] \OT1/cmtt/m/n/10.95 np : total number of points in each muffin-tin (in ,integer(nspecies))[] Underfull \hbox (badness 10000) in paragraph at lines 8990--8991 Underfull \hbox (badness 10000) in paragraph at lines 9019--9020 [153] Overfull \hbox (3.28027pt too wide) in paragraph at lines 9057--9057 [] \OT1/cmtt/m/n/10.95 nr : number of radial points for each species (in ,integer(nspecies))[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 9057--9057 [] \OT1/cmtt/m/n/10.95 nri : number of radial points on the inner part (i n,integer(nspecies))[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 9057--9057 [] \OT1/cmtt/m/n/10.95 np : total number of points in each muffin-tin (i n,integer(nspecies))[] Underfull \hbox (badness 10000) in paragraph at lines 9058--9059 [154] Underfull \hbox (badness 10000) in paragraph at lines 9094--9095 Overfull \hbox (26.27502pt too wide) in paragraph at lines 9125--9125 [] \OT1/cmtt/m/n/10.95 vca : vectors in Cartesian coordinates for all ato ms (in,real(3,natmtot)) Underfull \hbox (badness 10000) in paragraph at lines 9126--9127 Underfull \hbox (badness 10000) in paragraph at lines 9174--9175 [155] Underfull \hbox (badness 10000) in paragraph at lines 9226--9227 Underfull \hbox (badness 10000) in paragraph at lines 9249--9250 [156] Overfull \hbox (20.52634pt too wide) in paragraph at lines 9291--9291 [] \OT1/cmtt/m/n/10.95 apwalm : APW matching coefficients (in,complex(ngkma x,apwordmax,lmmaxapw))[] Underfull \hbox (badness 10000) in paragraph at lines 9292--9293 Underfull \hbox (badness 10000) in paragraph at lines 9340--9341 [157] Underfull \hbox (badness 10000) in paragraph at lines 9374--9375 Underfull \hbox (badness 10000) in paragraph at lines 9400--9401 [158] Underfull \hbox (badness 10000) in paragraph at lines 9465--9466 [159] Underfull \hbox (badness 10000) in paragraph at lines 9488--9489 Underfull \hbox (badness 10000) in paragraph at lines 9530--9531 [160] Underfull \hbox (badness 10000) in paragraph at lines 9565--9566 Underfull \hbox (badness 10000) in paragraph at lines 9603--9604 Underfull \hbox (badness 10000) in paragraph at lines 9629--9630 [161] Underfull \hbox (badness 10000) in paragraph at lines 9657--9658 Underfull \hbox (badness 10000) in paragraph at lines 9684--9685 [162] Underfull \hbox (badness 10000) in paragraph at lines 9708--9709 Underfull \hbox (badness 10000) in paragraph at lines 9739--9740 Overfull \hbox (16.14984pt too wide) in paragraph at lines 9742--9744 []\OT1/cmr/m/n/10.95 Writes the lin-eari-sa-tion en-er-gies for all APW and loc al-orbital func-tions to the file \OT1/cmtt/m/n/10.95 LINENGY.OUT\OT1/cmr/m/n/1 0.95 . [163] Underfull \hbox (badness 10000) in paragraph at lines 9771--9772 Underfull \hbox (badness 10000) in paragraph at lines 9807--9808 Underfull \hbox (badness 10000) in paragraph at lines 9839--9840 [164] Underfull \hbox (badness 10000) in paragraph at lines 9878--9879 Underfull \hbox (badness 10000) in paragraph at lines 9903--9904 [165] Underfull \hbox (badness 10000) in paragraph at lines 9932--9933 Underfull \hbox (badness 10000) in paragraph at lines 9957--9958 [166] Underfull \hbox (badness 10000) in paragraph at lines 10005--10006 Underfull \hbox (badness 10000) in paragraph at lines 10031--10032 [167] Underfull \hbox (badness 10000) in paragraph at lines 10052--10053 Underfull \hbox (badness 10000) in paragraph at lines 10072--10073 Underfull \hbox (badness 10000) in paragraph at lines 10094--10095 [168] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10122--10122 [] \OT1/cmtt/m/n/10.95 subroutine xc_pbe(n,kappa,mu,beta,rhoup,rhodn,grho,gup,g dn,g2up,g2dn,g3rho, & Underfull \hbox (badness 10000) in paragraph at lines 10143--10144 [169] Underfull \hbox (badness 10000) in paragraph at lines 10179--10180 Underfull \hbox (badness 10000) in paragraph at lines 10209--10210 [170] Underfull \hbox (badness 10000) in paragraph at lines 10242--10243 [171] Underfull \hbox (badness 10000) in paragraph at lines 10274--10275 Underfull \hbox (badness 10000) in paragraph at lines 10301--10302 [172] Overfull \hbox (3.28027pt too wide) in paragraph at lines 10333--10333 [] \OT1/cmtt/m/n/10.95 dy : rotation matrix for complex spherical harmoni cs (out,real(ld,*))[] Underfull \hbox (badness 10000) in paragraph at lines 10334--10335 Underfull \hbox (badness 10000) in paragraph at lines 10367--10368 [173] Underfull \hbox (badness 10000) in paragraph at lines 10392--10393 Underfull \hbox (badness 10000) in paragraph at lines 10417--10418 Underfull \hbox (badness 10000) in paragraph at lines 10442--10443 [174] Underfull \hbox (badness 10000) in paragraph at lines 10473--10474 [175] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10509--10509 [] \OT1/cmtt/m/n/10.95 nri : number of points on the inner part of the mu ffin-tin (in,integer)[] Underfull \hbox (badness 10000) in paragraph at lines 10510--10511 Overfull \hbox (14.77765pt too wide) in paragraph at lines 10546--10546 [] \OT1/cmtt/m/n/10.95 zfmt1 : first complex function in spherical harmonic s/coordinates for all Overfull \hbox (20.52634pt too wide) in paragraph at lines 10546--10546 [] \OT1/cmtt/m/n/10.95 zfmt2 : second complex function in spherical harmoni cs/coordinates for all[] [176] Underfull \hbox (badness 10000) in paragraph at lines 10547--10548 Underfull \hbox (badness 10000) in paragraph at lines 10577--10578 [177] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10622--10622 [] \OT1/cmtt/m/n/10.95 nri : number of points on the inner part of the mu ffin-tin (in,integer)[] Underfull \hbox (badness 10000) in paragraph at lines 10623--10624 Overfull \hbox (14.77765pt too wide) in paragraph at lines 10674--10674 [] \OT1/cmtt/m/n/10.95 nri : number of points on the inner part of the mu ffin-tin (in,integer)[] [178] Underfull \hbox (badness 10000) in paragraph at lines 10675--10676 Underfull \hbox (badness 10000) in paragraph at lines 10706--10707 [179] Underfull \hbox (badness 10000) in paragraph at lines 10755--10756 Overfull \hbox (14.77765pt too wide) in paragraph at lines 10782--10782 [] \OT1/cmtt/m/n/10.95 subroutine zpotcoul(nr,nri,np,npi,ld1,r,ngdg,igf,ngp,gpc ,gclgp,ld2,jlgprmt, & Overfull \hbox (14.77765pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 nr : number of radial points for each species ( in,integer(nspecies)) [180] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 jlgprmt : spherical Bessel functions for evergy G+p- vector and muffin-tin[] Overfull \hbox (14.77765pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 ylmgp : spherical harmonics of the G+p-vectors (in ,complex(lmmaxo,ngp))[] Overfull \hbox (9.02896pt too wide) in paragraph at lines 10806--10806 [] \OT1/cmtt/m/n/10.95 sfacgp : structure factors of the G+p-vectors (in,c omplex(ld2,natmtot))[] Underfull \hbox (badness 10000) in paragraph at lines 10807--10808 [181] Underfull \hbox (badness 10000) in paragraph at lines 10888--10889 [182] Underfull \hbox (badness 10000) in paragraph at lines 10923--10924 [183] (./elk.aux) ) (see the transcript file for additional information) Output written on elk.pdf (183 pages, 676312 bytes). Transcript written on elk.log. make[2]: Leaving directory '/build/elkcode-5.4.24/src' (cd src/spacegroup; /usr/bin/make doc) make[2]: Entering directory '/build/elkcode-5.4.24/src/spacegroup' ../protex -s main.f90 modmain.f90 readinput.f90 gencrystal.f90 sgsymb.f90 seitzgen.f90 gengroup.f90 seitzeq.f90 seitzmul.f90 writegeom.f90 geomplot.f90 findprimcell.f90 r3frac.f90 r3mv.f90 r3cross.f90 r3minv.f90 r3mm.f90 > spacegroup.tex Use of assignment to $[ is deprecated, and will be fatal in Perl 5.30 at ../protex line 95. pdflatex spacegroup;pdflatex spacegroup;pdflatex spacegroup This is pdfTeX, Version 3.14159265-2.6-1.40.19 (TeX Live 2019/dev/Debian) (preloaded format=pdflatex) restricted \write18 enabled. entering extended mode (./spacegroup.tex LaTeX2e <2018-12-01> (/usr/share/texlive/texmf-dist/tex/latex/base/article.cls Document Class: article 2018/09/03 v1.4i Standard LaTeX document class (/usr/share/texlive/texmf-dist/tex/latex/base/size11.clo)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsmath.sty For additional information on amsmath, use the `?' option. (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amstext.sty (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsgen.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsbsy.sty) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsopn.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amssymb.sty (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amsfonts.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/epsfig.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphicx.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/keyval.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphics.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/trig.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics-cfg/graphics.cfg) (/usr/share/texlive/texmf-dist/tex/latex/graphics-def/pdftex.def)))) (/usr/share/texlive/texmf-dist/tex/latex/tools/tabularx.sty (/usr/share/texlive/texmf-dist/tex/latex/tools/array.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/color.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics-cfg/color.cfg)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/hyperref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/hobsub-hyperref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/hobsub-generic.sty)) (/usr/share/texlive/texmf-dist/tex/generic/ifxetex/ifxetex.sty) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/auxhook.sty) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/kvoptions.sty) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/pd1enc.def) (/usr/share/texlive/texmf-dist/tex/latex/latexconfig/hyperref.cfg) (/usr/share/texlive/texmf-dist/tex/latex/url/url.sty)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/hpdftex.def (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/rerunfilecheck.sty)) No file spacegroup.aux. (/usr/share/texlive/texmf-dist/tex/context/base/mkii/supp-pdf.mkii [Loading MPS to PDF converter (version 2006.09.02).] ) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/epstopdf-base.sty (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/grfext.sty) (/usr/share/texlive/texmf-dist/tex/latex/latexconfig/epstopdf-sys.cfg)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/nameref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/gettitlestring.sty)) (./spacegroup.out) (./spacegroup.out) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsa.fd) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsb.fd) Overfull \hbox (17.24997pt too wide) in paragraph at lines 77--79 [][][][] Underfull \hbox (badness 10000) in paragraph at lines 77--79 [1{/var/lib/texmf/fonts/map/pdftex/updmap/pdftex.map}] [2] [3] [4] Overfull \vbox (38.86952pt too high) has occurred while \output is active [5] Overfull \vbox (38.86952pt too high) has occurred while \output is active [6] Overfull \vbox (38.86952pt too high) has occurred while \output is active [7] Overfull \vbox (38.86952pt too high) has occurred while \output is active [8] Overfull \vbox (38.86952pt too high) has occurred while \output is active [9] Overfull \vbox (38.86952pt too high) has occurred while \output is active [10] Overfull \vbox (38.86952pt too high) has occurred while \output is active [11] Overfull \vbox (38.86952pt too high) has occurred while \output is active [12] Overfull \vbox (38.86952pt too high) has occurred while \output is active [13] Overfull \vbox (38.86952pt too high) has occurred while \output is active [14] [15] Underfull \hbox (badness 10000) in paragraph at lines 811--812 Underfull \hbox (badness 10000) in paragraph at lines 860--861 [16] Underfull \hbox (badness 10000) in paragraph at lines 887--888 Underfull \hbox (badness 10000) in paragraph at lines 914--915 Underfull \hbox (badness 10000) in paragraph at lines 938--939 [17] Underfull \hbox (badness 10000) in paragraph at lines 961--962 Underfull \hbox (badness 10000) in paragraph at lines 985--986 [18] (./spacegroup.aux) LaTeX Warning: Label(s) may have changed. Rerun to get cross-references right. ) (see the transcript file for additional information) Output written on spacegroup.pdf (18 pages, 181672 bytes). Transcript written on spacegroup.log. This is pdfTeX, Version 3.14159265-2.6-1.40.19 (TeX Live 2019/dev/Debian) (preloaded format=pdflatex) restricted \write18 enabled. entering extended mode (./spacegroup.tex LaTeX2e <2018-12-01> (/usr/share/texlive/texmf-dist/tex/latex/base/article.cls Document Class: article 2018/09/03 v1.4i Standard LaTeX document class (/usr/share/texlive/texmf-dist/tex/latex/base/size11.clo)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsmath.sty For additional information on amsmath, use the `?' option. (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amstext.sty (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsgen.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsbsy.sty) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsopn.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amssymb.sty (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amsfonts.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/epsfig.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphicx.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/keyval.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphics.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/trig.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics-cfg/graphics.cfg) (/usr/share/texlive/texmf-dist/tex/latex/graphics-def/pdftex.def)))) (/usr/share/texlive/texmf-dist/tex/latex/tools/tabularx.sty (/usr/share/texlive/texmf-dist/tex/latex/tools/array.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/color.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics-cfg/color.cfg)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/hyperref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/hobsub-hyperref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/hobsub-generic.sty)) (/usr/share/texlive/texmf-dist/tex/generic/ifxetex/ifxetex.sty) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/auxhook.sty) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/kvoptions.sty) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/pd1enc.def) (/usr/share/texlive/texmf-dist/tex/latex/latexconfig/hyperref.cfg) (/usr/share/texlive/texmf-dist/tex/latex/url/url.sty)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/hpdftex.def (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/rerunfilecheck.sty)) (./spacegroup.aux) (/usr/share/texlive/texmf-dist/tex/context/base/mkii/supp-pdf.mkii [Loading MPS to PDF converter (version 2006.09.02).] ) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/epstopdf-base.sty (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/grfext.sty) (/usr/share/texlive/texmf-dist/tex/latex/latexconfig/epstopdf-sys.cfg)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/nameref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/gettitlestring.sty)) (./spacegroup.out) (./spacegroup.out) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsa.fd) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsb.fd) Overfull \hbox (17.24997pt too wide) in paragraph at lines 77--79 [][][][] Underfull \hbox (badness 10000) in paragraph at lines 77--79 [1{/var/lib/texmf/fonts/map/pdftex/updmap/pdftex.map}] (./spacegroup.toc) [2] [3] [4] Overfull \vbox (38.86952pt too high) has occurred while \output is active [5] Overfull \vbox (38.86952pt too high) has occurred while \output is active [6] Overfull \vbox (38.86952pt too high) has occurred while \output is active [7] Overfull \vbox (38.86952pt too high) has occurred while \output is active [8] Overfull \vbox (38.86952pt too high) has occurred while \output is active [9] Overfull \vbox (38.86952pt too high) has occurred while \output is active [10] Overfull \vbox (38.86952pt too high) has occurred while \output is active [11] Overfull \vbox (38.86952pt too high) has occurred while \output is active [12] Overfull \vbox (38.86952pt too high) has occurred while \output is active [13] Overfull \vbox (38.86952pt too high) has occurred while \output is active [14] [15] Underfull \hbox (badness 10000) in paragraph at lines 811--812 Underfull \hbox (badness 10000) in paragraph at lines 860--861 [16] Underfull \hbox (badness 10000) in paragraph at lines 887--888 Underfull \hbox (badness 10000) in paragraph at lines 914--915 Underfull \hbox (badness 10000) in paragraph at lines 938--939 [17] Underfull \hbox (badness 10000) in paragraph at lines 961--962 Underfull \hbox (badness 10000) in paragraph at lines 985--986 [18] (./spacegroup.aux) ) (see the transcript file for additional information) Output written on spacegroup.pdf (18 pages, 188318 bytes). Transcript written on spacegroup.log. This is pdfTeX, Version 3.14159265-2.6-1.40.19 (TeX Live 2019/dev/Debian) (preloaded format=pdflatex) restricted \write18 enabled. entering extended mode (./spacegroup.tex LaTeX2e <2018-12-01> (/usr/share/texlive/texmf-dist/tex/latex/base/article.cls Document Class: article 2018/09/03 v1.4i Standard LaTeX document class (/usr/share/texlive/texmf-dist/tex/latex/base/size11.clo)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsmath.sty For additional information on amsmath, use the `?' option. (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amstext.sty (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsgen.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsbsy.sty) (/usr/share/texlive/texmf-dist/tex/latex/amsmath/amsopn.sty)) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amssymb.sty (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/amsfonts.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/epsfig.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphicx.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/keyval.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics/graphics.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics/trig.sty) (/usr/share/texlive/texmf-dist/tex/latex/graphics-cfg/graphics.cfg) (/usr/share/texlive/texmf-dist/tex/latex/graphics-def/pdftex.def)))) (/usr/share/texlive/texmf-dist/tex/latex/tools/tabularx.sty (/usr/share/texlive/texmf-dist/tex/latex/tools/array.sty)) (/usr/share/texlive/texmf-dist/tex/latex/graphics/color.sty (/usr/share/texlive/texmf-dist/tex/latex/graphics-cfg/color.cfg)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/hyperref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/hobsub-hyperref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/hobsub-generic.sty)) (/usr/share/texlive/texmf-dist/tex/generic/ifxetex/ifxetex.sty) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/auxhook.sty) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/kvoptions.sty) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/pd1enc.def) (/usr/share/texlive/texmf-dist/tex/latex/latexconfig/hyperref.cfg) (/usr/share/texlive/texmf-dist/tex/latex/url/url.sty)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/hpdftex.def (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/rerunfilecheck.sty)) (./spacegroup.aux) (/usr/share/texlive/texmf-dist/tex/context/base/mkii/supp-pdf.mkii [Loading MPS to PDF converter (version 2006.09.02).] ) (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/epstopdf-base.sty (/usr/share/texlive/texmf-dist/tex/latex/oberdiek/grfext.sty) (/usr/share/texlive/texmf-dist/tex/latex/latexconfig/epstopdf-sys.cfg)) (/usr/share/texlive/texmf-dist/tex/latex/hyperref/nameref.sty (/usr/share/texlive/texmf-dist/tex/generic/oberdiek/gettitlestring.sty)) (./spacegroup.out) (./spacegroup.out) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsa.fd) (/usr/share/texlive/texmf-dist/tex/latex/amsfonts/umsb.fd) Overfull \hbox (17.24997pt too wide) in paragraph at lines 77--79 [][][][] Underfull \hbox (badness 10000) in paragraph at lines 77--79 [1{/var/lib/texmf/fonts/map/pdftex/updmap/pdftex.map}] (./spacegroup.toc) [2] [3] [4] Overfull \vbox (38.86952pt too high) has occurred while \output is active [5] Overfull \vbox (38.86952pt too high) has occurred while \output is active [6] Overfull \vbox (38.86952pt too high) has occurred while \output is active [7] Overfull \vbox (38.86952pt too high) has occurred while \output is active [8] Overfull \vbox (38.86952pt too high) has occurred while \output is active [9] Overfull \vbox (38.86952pt too high) has occurred while \output is active [10] Overfull \vbox (38.86952pt too high) has occurred while \output is active [11] Overfull \vbox (38.86952pt too high) has occurred while \output is active [12] Overfull \vbox (38.86952pt too high) has occurred while \output is active [13] Overfull \vbox (38.86952pt too high) has occurred while \output is active [14] [15] Underfull \hbox (badness 10000) in paragraph at lines 811--812 Underfull \hbox (badness 10000) in paragraph at lines 860--861 [16] Underfull \hbox (badness 10000) in paragraph at lines 887--888 Underfull \hbox (badness 10000) in paragraph at lines 914--915 Underfull \hbox (badness 10000) in paragraph at lines 938--939 [17] Underfull \hbox (badness 10000) in paragraph at lines 961--962 Underfull \hbox (badness 10000) in paragraph at lines 985--986 [18] (./spacegroup.aux) ) (see the transcript file for additional information) Output written on spacegroup.pdf (18 pages, 188318 bytes). Transcript written on spacegroup.log. make[2]: Leaving directory '/build/elkcode-5.4.24/src/spacegroup' make[1]: Leaving directory '/build/elkcode-5.4.24' debian/rules override_dh_auto_test make[1]: Entering directory '/build/elkcode-5.4.24' (cd tests; OMPI_MCA_orte_rsh_agent=/bin/false bash ./tests_quick.sh) Running test in directory test-001... -------------------------------------------------------------------------- [[55940,1],0]: A high-performance Open MPI point-to-point messaging module was unable to find any relevant network interfaces: Module: OpenFabrics (openib) Host: i-capture-the-hostname Another transport will be used instead, although this may result in lower performance. NOTE: You can disable this warning by setting the MCA parameter btl_base_warn_component_unused to 0. -------------------------------------------------------------------------- Elk code version 5.4.24 started Number of MPI processes : 1 Number of CPUs per MPI process : 16 Number of OpenMP threads per MPI process : 16 Nested OpenMP : T OpenMP dynamic thread adjustment : F Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 3 (Cu) from 2.4000 to 1.9694 Info(checkmt): reduced muffin-tin radius of species 4 (O) from 1.8000 to 1.4770 Info(findsymcrys): atomic basis shift (lattice) : -0.5000000000 -0.5000000000 -0.5000000000 See GEOMETRY.OUT for new atomic positions Warning(gndstate): failed to reach self-consistency after 2 loops Info(elk): current task : 1 Warning(gndstate): failed to reach self-consistency after 2 loops Info(elk): current task : 500 Info(testcheck): passed all tests Elk code stopped Passed Running test in directory test-002... -------------------------------------------------------------------------- [[59633,1],0]: A high-performance Open MPI point-to-point messaging module was unable to find any relevant network interfaces: Module: OpenFabrics (openib) Host: i-capture-the-hostname Another transport will be used instead, although this may result in lower performance. NOTE: You can disable this warning by setting the MCA parameter btl_base_warn_component_unused to 0. -------------------------------------------------------------------------- Elk code version 5.4.24 started Number of MPI processes : 1 Number of CPUs per MPI process : 16 Number of OpenMP threads per MPI process : 16 Nested OpenMP : T OpenMP dynamic thread adjustment : F Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.3202 Warning(gndstate): failed to reach self-consistency after 5 loops Info(elk): current task : 500 Info(testcheck): passed all tests Elk code stopped Passed Running test in directory test-003... -------------------------------------------------------------------------- [[57717,1],0]: A high-performance Open MPI point-to-point messaging module was unable to find any relevant network interfaces: Module: OpenFabrics (openib) Host: i-capture-the-hostname Another transport will be used instead, although this may result in lower performance. NOTE: You can disable this warning by setting the MCA parameter btl_base_warn_component_unused to 0. -------------------------------------------------------------------------- Elk code version 5.4.24 started Number of MPI processes : 1 Number of CPUs per MPI process : 16 Number of OpenMP threads per MPI process : 16 Nested OpenMP : T OpenMP dynamic thread adjustment : F Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1436 Info(findsymcrys): atomic basis shift (lattice) : 0.3650000000 0.3650000000 0.3650000000 See GEOMETRY.OUT for new atomic positions Warning(gndstate): failed to reach self-consistency after 10 loops Info(elk): current task : 500 Info(testcheck): passed all tests Elk code stopped Passed Running test in directory test-005... -------------------------------------------------------------------------- [[57981,1],0]: A high-performance Open MPI point-to-point messaging module was unable to find any relevant network interfaces: Module: OpenFabrics (openib) Host: i-capture-the-hostname Another transport will be used instead, although this may result in lower performance. NOTE: You can disable this warning by setting the MCA parameter btl_base_warn_component_unused to 0. -------------------------------------------------------------------------- Elk code version 5.4.24 started Number of MPI processes : 1 Number of CPUs per MPI process : 16 Number of OpenMP threads per MPI process : 16 Nested OpenMP : T OpenMP dynamic thread adjustment : F Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.3615 Warning(gndstate): failed to reach self-consistency after 5 loops Info(elk): current task : 500 Info(testcheck): passed all tests Elk code stopped Passed Running test in directory test-007... -------------------------------------------------------------------------- [[64482,1],0]: A high-performance Open MPI point-to-point messaging module was unable to find any relevant network interfaces: Module: OpenFabrics (openib) Host: i-capture-the-hostname Another transport will be used instead, although this may result in lower performance. NOTE: You can disable this warning by setting the MCA parameter btl_base_warn_component_unused to 0. -------------------------------------------------------------------------- Elk code version 5.4.24 started Number of MPI processes : 1 Number of CPUs per MPI process : 16 Number of OpenMP threads per MPI process : 16 Nested OpenMP : T OpenMP dynamic thread adjustment : F Info(elk): current task : 0 Info(elk): current task : 500 Info(testcheck): passed all tests Elk code stopped Passed Running test in directory test-009... -------------------------------------------------------------------------- [[33399,1],0]: A high-performance Open MPI point-to-point messaging module was unable to find any relevant network interfaces: Module: OpenFabrics (openib) Host: i-capture-the-hostname Another transport will be used instead, although this may result in lower performance. NOTE: You can disable this warning by setting the MCA parameter btl_base_warn_component_unused to 0. -------------------------------------------------------------------------- Elk code version 5.4.24 started Number of MPI processes : 1 Number of CPUs per MPI process : 16 Number of OpenMP threads per MPI process : 16 Nested OpenMP : T OpenMP dynamic thread adjustment : F Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (B) from 1.8000 to 1.6129 Info(checkmt): reduced muffin-tin radius of species 2 (N+) from 1.4500 to 1.2993 Warning(gndstate): failed to reach self-consistency after 6 loops Info(elk): current task : 140 Info(elnes): 1 of 8 k-points Info(elnes): 8 of 8 k-points Info(elnes): 4 of 8 k-points Info(elnes): 5 of 8 k-points Info(elnes): 7 of 8 k-points Info(elnes): 3 of 8 k-points Info(elnes): 2 of 8 k-points Info(elnes): 6 of 8 k-points Info(elnes): ELNES double differential cross-section written to ELNES.OUT Info(elk): current task : 500 Info(testcheck): passed all tests Elk code stopped Passed Running test in directory test-010... -------------------------------------------------------------------------- [[43157,1],0]: A high-performance Open MPI point-to-point messaging module was unable to find any relevant network interfaces: Module: OpenFabrics (openib) Host: i-capture-the-hostname Another transport will be used instead, although this may result in lower performance. NOTE: You can disable this warning by setting the MCA parameter btl_base_warn_component_unused to 0. -------------------------------------------------------------------------- Elk code version 5.4.24 started Number of MPI processes : 1 Number of CPUs per MPI process : 16 Number of OpenMP threads per MPI process : 16 Nested OpenMP : T OpenMP dynamic thread adjustment : F Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (O) from 1.8000 to 0.9906 Info(checkmt): reduced muffin-tin radius of species 2 (H) from 1.4000 to 0.7704 Warning(linengy): could not find 1 linearisation energies in s.c. loop 1 Warning(gndstate): failed to reach self-consistency after 2 loops Warning(linengy): could not find 1 linearisation energies in s.c. loop 2 Info(elk): current task : 500 Info(testcheck): passed all tests Elk code stopped Passed Running test in directory test-011... -------------------------------------------------------------------------- [[41356,1],0]: A high-performance Open MPI point-to-point messaging module was unable to find any relevant network interfaces: Module: OpenFabrics (openib) Host: i-capture-the-hostname Another transport will be used instead, although this may result in lower performance. NOTE: You can disable this warning by setting the MCA parameter btl_base_warn_component_unused to 0. -------------------------------------------------------------------------- Elk code version 5.4.24 started Number of MPI processes : 1 Number of CPUs per MPI process : 16 Number of OpenMP threads per MPI process : 16 Nested OpenMP : T OpenMP dynamic thread adjustment : F Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Warning(gndstate): failed to reach self-consistency after 2 loops Info(elk): current task : 5 Info(genkmat): 1 of 2 k-points Info(genkmat): 2 of 2 k-points Info(hartfock): self-consistent loop number : 1 Info(eveqnhf): 1 of 2 k-points Info(eveqnhf): 2 of 2 k-points Info(hartfock): self-consistent loop number : 2 Info(eveqnhf): 1 of 2 k-points Info(eveqnhf): 2 of 2 k-points Info(exxengy): 1 of 2 k-points Info(exxengy): 2 of 2 k-points Info(elk): current task : 500 Info(testcheck): passed all tests Elk code stopped Passed Running test in directory test-013... -------------------------------------------------------------------------- [[52216,1],0]: A high-performance Open MPI point-to-point messaging module was unable to find any relevant network interfaces: Module: OpenFabrics (openib) Host: i-capture-the-hostname Another transport will be used instead, although this may result in lower performance. NOTE: You can disable this warning by setting the MCA parameter btl_base_warn_component_unused to 0. -------------------------------------------------------------------------- Elk code version 5.4.24 started Number of MPI processes : 1 Number of CPUs per MPI process : 16 Number of OpenMP threads per MPI process : 16 Nested OpenMP : T OpenMP dynamic thread adjustment : F Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Fe) from 2.4000 to 2.3579 Info(checkmt): reduced muffin-tin radius of species 2 (Al) from 2.2000 to 2.1614 Warning(gndstate): failed to reach self-consistency after 2 loops Info(elk): current task : 500 Info(testcheck): passed all tests Elk code stopped Passed Running test in directory test-014... -------------------------------------------------------------------------- [[56538,1],0]: A high-performance Open MPI point-to-point messaging module was unable to find any relevant network interfaces: Module: OpenFabrics (openib) Host: i-capture-the-hostname Another transport will be used instead, although this may result in lower performance. NOTE: You can disable this warning by setting the MCA parameter btl_base_warn_component_unused to 0. -------------------------------------------------------------------------- Elk code version 5.4.24 started Number of MPI processes : 1 Number of CPUs per MPI process : 16 Number of OpenMP threads per MPI process : 16 Nested OpenMP : T OpenMP dynamic thread adjustment : F Info(elk): current task : 0 Info(checkmt): reduced muffin-tin radius of species 1 (Si) from 2.2000 to 2.1964 Info(findsymcrys): atomic basis shift (lattice) : 0.3750000000 0.3750000000 0.3750000000 See GEOMETRY.OUT for new atomic positions Info(oepvcl): 1 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepvcl): 5 of 8 k-points Info(oepmain): done 10 iterations of 50 Info(oepmain): done 20 iterations of 50 Info(oepmain): done 30 iterations of 50 Info(oepmain): done 40 iterations of 50 Info(oepmain): done 50 iterations of 50 Warning(gndstate): failed to reach self-consistency after 2 loops Info(oepvcl): 1 of 8 k-points Info(oepvcl): 7 of 8 k-points Info(oepvcl): 2 of 8 k-points Info(oepvcl): 6 of 8 k-points Info(oepvcl): 4 of 8 k-points Info(oepvcl): 5 of 8 k-points Info(oepvcl): 8 of 8 k-points Info(oepvcl): 3 of 8 k-points Info(oepmain): done 10 iterations of 50 Info(oepmain): done 20 iterations of 50 Info(oepmain): done 30 iterations of 50 Info(oepmain): done 40 iterations of 50 Info(oepmain): done 50 iterations of 50 Info(exxengy): 1 of 8 k-points Info(exxengy): 8 of 8 k-points Info(exxengy): 2 of 8 k-points Info(exxengy): 4 of 8 k-points Info(exxengy): 3 of 8 k-points Info(exxengy): 5 of 8 k-points Info(exxengy): 6 of 8 k-points Info(exxengy): 7 of 8 k-points Info(elk): current task : 500 Info(testcheck): passed all tests Elk code stopped Passed Running test in directory test-018... -------------------------------------------------------------------------- [[50751,1],0]: A high-performance Open MPI point-to-point messaging module was unable to find any relevant network interfaces: Module: OpenFabrics (openib) Host: i-capture-the-hostname Another transport will be used instead, although this may result in lower performance. NOTE: You can disable this warning by setting the MCA parameter btl_base_warn_component_unused to 0. -------------------------------------------------------------------------- Elk code version 5.4.24 started Number of MPI processes : 1 Number of CPUs per MPI process : 16 Number of OpenMP threads per MPI process : 16 Nested OpenMP : T OpenMP dynamic thread adjustment : F Info(elk): current task : 0 Info(elk): current task : 205 Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P1.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P1.OUT Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P1.OUT Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P2.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P2.OUT Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P2.OUT Info(phonon): working on DYN_Q0000_0000_0000_S01_A001_P3.OUT Info(phonon): working on DYN_Q0102_0000_0000_S01_A001_P3.OUT Info(phonon): working on DYN_Q0102_0102_0102_S01_A001_P3.OUT Info(dyntask): nothing more to do Info(elk): current task : 210 Info(phdos): phonon density of states written to PHDOS.OUT thermodynamic properties written to THERMO.OUT Info(elk): current task : 500 Info(testcheck): passed all tests Elk code stopped Passed for i in tests/test-*/test.log; do \ if [ -e $i ]; then \ echo "Error for test $i:"; \ sed -n -e '/^Error/,$p' $i; \ fi \ done make[1]: Leaving directory '/build/elkcode-5.4.24' fakeroot debian/rules binary dh binary dh: Compatibility levels before 9 are deprecated (level 8 in use) dh_testroot dh_prep dh_installdirs dh_installdirs: Compatibility levels before 9 are deprecated (level 8 in use) dh_auto_install dh_auto_install: Compatibility levels before 9 are deprecated (level 8 in use) debian/rules override_dh_install make[1]: Entering directory '/build/elkcode-5.4.24' dh_install dh_install: Compatibility levels before 9 are deprecated (level 8 in use) mv /build/elkcode-5.4.24/debian/elk-lapw/usr/bin/xps_exc.pl \ /build/elkcode-5.4.24/debian/elk-lapw/usr/bin/xps_exc mv /build/elkcode-5.4.24/debian/elk-lapw/usr/bin/elk \ /build/elkcode-5.4.24/debian/elk-lapw/usr/bin/elk-lapw #bug #720044 make[1]: Leaving directory '/build/elkcode-5.4.24' dh_installdocs dh_installdocs: Compatibility levels before 9 are deprecated (level 8 in use) debian/rules override_dh_installchangelogs make[1]: Entering directory '/build/elkcode-5.4.24' dh_installchangelogs release_notes.txt make[1]: Leaving directory '/build/elkcode-5.4.24' dh_installexamples dh_installexamples: Compatibility levels before 9 are deprecated (level 8 in use) dh_installman dh_installman: Compatibility levels before 9 are deprecated (level 8 in use) dh_perl dh_link dh_strip_nondeterminism dh_compress dh_compress: Compatibility levels before 9 are deprecated (level 8 in use) dh_fixperms dh_missing dh_missing: Compatibility levels before 9 are deprecated (level 8 in use) dh_strip dh_strip: Compatibility levels before 9 are deprecated (level 8 in use) dh_makeshlibs dh_shlibdeps dh_shlibdeps: Compatibility levels before 9 are deprecated (level 8 in use) dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/elk-lapw/usr/bin/spacegroup debian/elk-lapw/usr/bin/elk-lapw debian/elk-lapw/usr/bin/eos were not linked against libpthread.so.0 (they use none of the library's symbols) dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/elk-lapw/usr/bin/elk-lapw was not linked against libxc.so.5 (it uses none of the library's symbols) dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/elk-lapw/usr/bin/spacegroup debian/elk-lapw/usr/bin/elk-lapw debian/elk-lapw/usr/bin/eos were not linked against libquadmath.so.0 (they use none of the library's symbols) dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/elk-lapw/usr/bin/spacegroup debian/elk-lapw/usr/bin/elk-lapw debian/elk-lapw/usr/bin/eos were not linked against libmpi_usempif08.so.40 (they use none of the library's symbols) dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/elk-lapw/usr/bin/spacegroup debian/elk-lapw/usr/bin/elk-lapw debian/elk-lapw/usr/bin/eos were not linked against libmpi.so.40 (they use none of the library's symbols) dpkg-shlibdeps: warning: package could avoid a useless dependency if debian/elk-lapw/usr/bin/spacegroup debian/elk-lapw/usr/bin/elk-lapw debian/elk-lapw/usr/bin/eos were not linked against libmpi_usempi_ignore_tkr.so.40 (they use none of the library's symbols) dh_installdeb dh_installdeb: Compatibility levels before 9 are deprecated (level 8 in use) dh_gencontrol dpkg-gencontrol: warning: package elk-lapw: substitution variable ${perl:Depends} unused, but is defined dpkg-gencontrol: warning: package elk-lapw: substitution variable ${perl:Depends} unused, but is defined dh_md5sums dh_builddeb dpkg-deb: building package 'elk-lapw-dbgsym' in '../elk-lapw-dbgsym_5.4.24-2_amd64.deb'. dpkg-deb: building package 'elk-lapw' in '../elk-lapw_5.4.24-2_amd64.deb'. dpkg-genbuildinfo --build=binary dpkg-genchanges --build=binary >../elkcode_5.4.24-2_amd64.changes dpkg-genchanges: info: binary-only upload (no source code included) dpkg-source --after-build . dpkg-buildpackage: info: binary-only upload (no source included) I: copying local configuration I: user script /srv/workspace/pbuilder/33056/tmp/hooks/B01_cleanup starting I: user script /srv/workspace/pbuilder/33056/tmp/hooks/B01_cleanup finished I: unmounting dev/ptmx filesystem I: unmounting dev/pts filesystem I: unmounting dev/shm filesystem I: unmounting proc filesystem I: unmounting sys filesystem I: cleaning the build env I: removing directory /srv/workspace/pbuilder/33056 and its subdirectories I: Current time: Sat Jan 22 15:30:07 +14 2022 I: pbuilder-time-stamp: 1642815007