<div dir="ltr"><div>Dear <span style="font-family: arial, sans-serif;">Julita,</span></div><div><span style="font-family: arial, sans-serif;">On a Cray system, you don't need to install GCC, FFTW, MPICH and SCALAPACK, they are already provided by Cray.</span></div><div><span style="font-family: arial, sans-serif;">So, my first proposal is that you compile CP2K and use the internal arch file</span></div><div><span style="font-family: arial, sans-serif;"><br></span></div><div><a href="https://github.com/cp2k/cp2k/blob/master/arch/CRAY-XC30-gfortran.psmp">https://github.com/cp2k/cp2k/blob/master/arch/CRAY-XC30-gfortran.psmp</a><span style="font-family: arial, sans-serif;"><br></span></div><div><span style="font-family: arial, sans-serif;"><br></span></div><div><font face="arial, sans-serif">Make sure you load the right modules, i.e.</font></div><div><font face="arial, sans-serif"><br></font></div><div><font face="arial, sans-serif">module swap PrgEnv-cray PrgEnv-gnu</font></div><div><font face="arial, sans-serif">module load fftw</font></div><div><font face="arial, sans-serif"><br></font></div><div><font face="arial, sans-serif">(SCALAPACK comes with cray-libsci)</font></div><div><font face="arial, sans-serif"><br></font></div><div><font face="arial, sans-serif">If it works, then the next step will be to install specific libraries, such as LIBINT, LIBXC, LIBXSMM... It depends which are relevant to you. Likely you have to install one by one by hand and link to CP2K...</font></div><div><font face="arial, sans-serif"><br></font></div><div><font face="arial, sans-serif">Alfio</font></div><div><span style="font-family: arial, sans-serif;"><br></span></div><br><br>Il giorno sabato 25 maggio 2019 21:18:56 UTC+2, JULITA INCA CHIROQUE ha scritto:<blockquote class="gmail_quote" style="margin: 0;margin-left: 0.8ex;border-left: 1px #ccc solid;padding-left: 1ex;"><div dir="ltr"><div dir="ltr"><div dir="ltr"><div dir="ltr"><div dir="ltr">Hello,</div><div dir="ltr"><br></div><div dir="ltr">I was able to install cp2k6.1 with these options:</div><div dir="ltr"><br></div><div dir="ltr"><code style="color:rgb(0,0,0)">./install_cp2k_toolchain.sh -j 72 --enable-cuda=no --with-scalapack --with-libxsmm=no --with-reflapack=no --with-libint=no --with-libxc=no --with-openblas=no</code></div><div dir="ltr"><font color="#000000" face="monospace"><span><br></span></font></div><div dir="ltr"><font color="#000000" face="monospace"><span>Then, I executed the commands:</span></font></div><div dir="ltr"><pre lang="shell" style="color:rgb(0,0,0)"><span lang="shell"><span>cp /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/toolchain/install/arch/*  arch/</span></span><span lang="shell"><span><br></span></span></pre><pre lang="shell" style="color:rgb(0,0,0)"><span lang="shell"><span>source /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/toolchain/install/setup</span></span><span lang="shell"><span><br></span></span></pre><pre lang="shell" style="color:rgb(0,0,0)"><span lang="shell"><span>cd makefiles/</span></span></pre><pre lang="shell" style="color:rgb(0,0,0)"><span lang="shell"><span>However, the installation look into another $HOME path, even though I set in source my cp2k path installation:</span></span></pre><div><p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961);min-height:16px"><span></span><br></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>jinca@eslogin005:/home2/y07/<wbr>y07/cse/xalt/0.6.0/bin> source /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/toolchain/install/setup</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>jinca@eslogin005:/home2/y07/<wbr>y07/cse/xalt/0.6.0/bin> cd /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>makefiles/</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>jinca@eslogin005:/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/makefiles> make -j 72 ARCH=local VERSION="popt"</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Discovering programs ...</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Removing stale archives for popt ... </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Resolving dependencies for popt ... </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/acc/acc_stream.F acc_stream.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/dbcsr/dist/dbcsr_min_heap.<wbr>F dbcsr_min_heap.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Updating archive /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>lib/local/popt/libcp2kmpiwrap.<wbr>a</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ar: creating /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>lib/local/popt/libcp2kmpiwrap.<wbr>a</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/erf_fn.F erf_fn.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/spherical_<wbr>harmonics.F spherical_harmonics.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/cp_iter_types.F cp_iter_types.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/list_<wbr>callstackentry.F list_callstackentry.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/list_routinestat.F list_routinestat.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"dbcsr/<wbr>dist/dbcsr_min_heap.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/dbcsr/dist/' dbcsr_min_heap.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/dict.F dict.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"acc/acc_<wbr>stream.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/acc/' acc_stream.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/cuda_profiling.F cuda_profiling.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/lebedev.F lebedev.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/mathlib.F mathlib.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/structure_factor_<wbr>types.F structure_factor_types.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/cp_para_env.F cp_para_env.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/string_table.F string_table.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/parallel_rng_types.<wbr>F parallel_rng_types.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/gamma.F gamma.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/powell.F powell.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/xml_parser.F xml_parser.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/splines.F splines.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/eigenvalueproblems.<wbr>F eigenvalueproblems.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/whittaker.F whittaker.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/linear_systems.F linear_systems.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/periodic_table.F periodic_table.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/metadyn_tools/graph_utils.<wbr>F graph_utils.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/input/cp_parser_inpp_<wbr>types.F cp_parser_inpp_types.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>erf_fn.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' erf_fn.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/input/cp_parser_status_<wbr>types.F cp_parser_status_types.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/cp_<wbr>iter_types.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' cp_iter_types.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/mixed_energy_types.F mixed_energy_types.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/subsys/shell_potential_<wbr>types.F shell_potential_types.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>cuda_profiling.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' cuda_profiling.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/subsys/damping_dipole_<wbr>types.F damping_dipole_types.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>spherical_harmonics.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' spherical_harmonics.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/subsys/atprop_types.F atprop_types.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>mathlib.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' mathlib.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>string_table.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' string_table.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/subsys/force_field_kind_<wbr>types.F force_field_kind_types.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>structure_factor_types.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' structure_factor_types.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/pw/pw_grid_types.F pw_grid_types.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>list_callstackentry.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' list_callstackentry.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>lebedev.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' lebedev.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/cp_<wbr>para_env.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' cp_para_env.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/pw/fft/mltfftsg_tools.F mltfftsg_tools.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>parallel_rng_types.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' parallel_rng_types.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>gamma.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' gamma.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/pw/fft/fftw3_lib.F fftw3_lib.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>dict.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' dict.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>powell.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' powell.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>xml_parser.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' xml_parser.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>splines.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' splines.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>eigenvalueproblems.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' eigenvalueproblems.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>whittaker.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' whittaker.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"metadyn_<wbr>tools/graph_utils.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/metadyn_tools/' graph_utils.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>linear_systems.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' linear_systems.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"common/<wbr>periodic_table.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/common/' periodic_table.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"input/cp_<wbr>parser_inpp_types.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/input/' cp_parser_inpp_types.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"subsys/<wbr>shell_potential_types.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/subsys/' shell_potential_types.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>tools/build_utils/fypp -n /work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/fm/cp_blacs_calls.F cp_blacs_calls.F90</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Warning:</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Unable to determine ld version.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Default linker script will be used.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961);min-height:16px"><span></span><br></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Error: Problem invoking pkg-config.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Warning:</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Unable to determine ld version.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Warning:</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Unable to determine ld version.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Default linker script will be used.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961);min-height:16px"><span></span><br></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Default linker script will be used.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961);min-height:16px"><span></span><br></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Warning:</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Unable to determine ld version.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Default linker script will be used.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961);min-height:16px"><span></span><br></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Error: Problem invoking pkg-config.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Warning:</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Unable to determine ld version.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Default linker script will be used.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961);min-height:16px"><span></span><br></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Warning:</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Unable to determine ld version.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Default linker script will be used.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961);min-height:16px"><span></span><br></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Error: Problem invoking pkg-config.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: line 44: /xalt_helper_functions.sh: No such file or directory</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Error: Problem invoking pkg-config.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: line 44: /xalt_helper_functions.sh: No such file or directory</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Failed to fork - Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: line 48: request_tracing: command not found</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: line 48: request_tracing: command not found</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: line 55: find_real_command: command not found</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: line 55: find_real_command: command not found</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: line 60: find_working_python: command not found</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: line 60: find_working_python: command not found</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Warning:</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Unable to determine ld version.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Default linker script will be used.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961);min-height:16px"><span></span><br></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Warning:</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Unable to determine ld version.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Default linker script will be used.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961);min-height:16px"><span></span><br></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"input/cp_<wbr>parser_status_types.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/input/' cp_parser_status_types.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"mixed_<wbr>energy_types.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/' mixed_energy_types.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"subsys/<wbr>damping_dipole_types.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/subsys/' damping_dipole_types.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"subsys/<wbr>atprop_types.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/subsys/' atprop_types.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"subsys/<wbr>force_field_kind_types.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/subsys/' force_field_kind_types.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>make[3]: *** [structure_factor_types.o] Error 1</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>make[3]: *** Waiting for unfinished jobs....</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>make[3]: *** [splines.o] Error 1</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>make[3]: *** [whittaker.o] Error 1</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>make[3]: *** [cp_parser_inpp_types.o] Error 1</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>make[3]: *** [shell_potential_types.o] Error 1</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>ftn -c -march=native -fno-omit-frame-pointer -g  -O3 -funroll-loops -ffast-math     -ffree-form -std=f2003 -fimplicit-none  -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Werror=tabs -Werror=realloc-lhs-all -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-<wbr>variable -Werror=unused-variable -Werror=unused-dummy-argument -Werror=conversion -Werror=zerotrip -Werror=uninitialized -Wno-maybe-uninitialized -Wuse-without-only  -D__parallel -D__MPI_VERSION=3 -D__FFTW3  -D__SCALAPACK   -D__COMPILE_ARCH="\"local\"" -D__COMPILE_DATE="\"Sat May 25 20:08:14 BST 2019\"" -D__COMPILE_HOST="\"<wbr>eslogin005\"" -D__COMPILE_REVISION="\"svn:<wbr>18464\"" -D__DATA_DIR="\"/work/d167/<wbr>d167/jinca/Dissertation/<wbr>Downloads/cp2k/data\"" -D__SHORT_FILE__="\"pw/pw_<wbr>grid_types.F\"" -I'/work/d167/d167/jinca/<wbr>Dissertation/Downloads/cp2k/<wbr>src/pw/' pw_grid_types.F90 </span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Warning:</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Unable to determine ld version.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Default linker script will be used.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961);min-height:16px"><span></span><br></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/opt/gcc/7.2.0/bin/gfortran: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Error: Problem invoking pkg-config.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>make[3]: *** [atprop_types.o] Error 1</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>make[3]: *** [list_callstackentry.o] Error 128</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/opt/gcc/7.2.0/bin/gfortran: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/opt/gcc/7.2.0/bin/gfortran: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Warning:</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Unable to determine ld version.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Default linker script will be used.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961);min-height:16px"><span></span><br></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>make[3]: *** [parallel_rng_types.o] Error 128</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>make[3]: *** [dict.o] Error 128</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/home/y07/y07/cse/xalt/0.6.0/<wbr>bin/ld: fork: Resource temporarily unavailable</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>Error: Problem invoking pkg-config.</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>make[3]: *** [periodic_table.o] Error 1</span></p>
<p style="margin:0px;font-stretch:normal;font-size:14px;line-height:normal;font-family:Menlo;color:rgb(47,255,18);background-color:rgba(0,0,0,0.901961)"><span>/usr/bin/dirname: missing operand</span></p>
</div></div></div></div></div></div>...</blockquote></div>