[CP2K-user] Compiling CP2K6.1 with the minimal packages

[JULITA INCA CHIROQUE]

Hello,

I was able to install cp2k6.1 with these options:

./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

Then, I executed the commands:

cp /work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/toolchain/install/arch/*
 arch/

source /work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/toolchain/install/setup

cd makefiles/

However, the installation look into another $HOME path, even though I
set in source my cp2k path installation:


jinca at eslogin005:/home2/y07/y07/cse/xalt/0.6.0/bin> source
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/toolchain/install/setup

jinca at eslogin005:/home2/y07/y07/cse/xalt/0.6.0/bin> cd
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/makefiles/

jinca at eslogin005:/work/d167/d167/jinca/Dissertation/Downloads/cp2k/makefiles>
make -j 72 ARCH=local VERSION="popt"

Discovering programs ...

Removing stale archives for popt ...

Resolving dependencies for popt ...

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/acc/acc_stream.F
acc_stream.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/dbcsr/dist/dbcsr_min_heap.F
dbcsr_min_heap.F90

Updating archive
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/lib/local/popt/libcp2kmpiwrap.a

ar: creating
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/lib/local/popt/libcp2kmpiwrap.a

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/erf_fn.F
erf_fn.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/spherical_harmonics.F
spherical_harmonics.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/cp_iter_types.F
cp_iter_types.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/list_callstackentry.F
list_callstackentry.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/list_routinestat.F
list_routinestat.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"dbcsr/dist/dbcsr_min_heap.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/dbcsr/dist/'
dbcsr_min_heap.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/dict.F dict.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"acc/acc_stream.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/acc/'
acc_stream.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/cuda_profiling.F
cuda_profiling.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/lebedev.F
lebedev.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/mathlib.F
mathlib.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/structure_factor_types.F
structure_factor_types.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/cp_para_env.F
cp_para_env.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/string_table.F
string_table.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/parallel_rng_types.F
parallel_rng_types.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/gamma.F
gamma.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/powell.F
powell.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/xml_parser.F
xml_parser.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/splines.F
splines.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/eigenvalueproblems.F
eigenvalueproblems.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/whittaker.F
whittaker.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/linear_systems.F
linear_systems.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/periodic_table.F
periodic_table.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/metadyn_tools/graph_utils.F
graph_utils.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/input/cp_parser_inpp_types.F
cp_parser_inpp_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/erf_fn.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
erf_fn.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/input/cp_parser_status_types.F
cp_parser_status_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/cp_iter_types.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
cp_iter_types.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/mixed_energy_types.F
mixed_energy_types.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/subsys/shell_potential_types.F
shell_potential_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/cuda_profiling.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
cuda_profiling.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/subsys/damping_dipole_types.F
damping_dipole_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/spherical_harmonics.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
spherical_harmonics.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/subsys/atprop_types.F
atprop_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/mathlib.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
mathlib.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/string_table.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
string_table.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/subsys/force_field_kind_types.F
force_field_kind_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/structure_factor_types.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
structure_factor_types.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/pw/pw_grid_types.F
pw_grid_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/list_callstackentry.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
list_callstackentry.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/lebedev.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
lebedev.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/cp_para_env.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
cp_para_env.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/pw/fft/mltfftsg_tools.F
mltfftsg_tools.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/parallel_rng_types.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
parallel_rng_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/gamma.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/' gamma.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/pw/fft/fftw3_lib.F
fftw3_lib.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/dict.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/' dict.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/powell.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
powell.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/xml_parser.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
xml_parser.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/splines.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
splines.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/eigenvalueproblems.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
eigenvalueproblems.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/whittaker.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
whittaker.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"metadyn_tools/graph_utils.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/metadyn_tools/'
graph_utils.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/linear_systems.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
linear_systems.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/periodic_table.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
periodic_table.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"input/cp_parser_inpp_types.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/input/'
cp_parser_inpp_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"subsys/shell_potential_types.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/subsys/'
shell_potential_types.F90

/work/d167/d167/jinca/Dissertation/Downloads/cp2k/tools/build_utils/fypp -n
/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/fm/cp_blacs_calls.F
cp_blacs_calls.F90

/home/y07/y07/cse/xalt/0.6.0/bin/ld: fork: Resource temporarily unavailable

Warning:

Unable to determine ld version.

Default linker script will be used.


/home/y07/y07/cse/xalt/0.6.0/bin/ld: fork: Resource temporarily unavailable

/home/y07/y07/cse/xalt/0.6.0/bin/ld: fork: Resource temporarily unavailable

Error: Problem invoking pkg-config.

Warning:

Unable to determine ld version.

Warning:

Unable to determine ld version.

Default linker script will be used.


Default linker script will be used.


/home/y07/y07/cse/xalt/0.6.0/bin/ld: fork: Resource temporarily unavailable

Warning:

Unable to determine ld version.

Default linker script will be used.


/home/y07/y07/cse/xalt/0.6.0/bin/ld: fork: Resource temporarily unavailable

Error: Problem invoking pkg-config.

/home/y07/y07/cse/xalt/0.6.0/bin/ld: fork: Resource temporarily unavailable

Warning:

Unable to determine ld version.

Default linker script will be used.


Warning:

Unable to determine ld version.

/home/y07/y07/cse/xalt/0.6.0/bin/ld: fork: Resource temporarily unavailable

Default linker script will be used.


Error: Problem invoking pkg-config.

/home/y07/y07/cse/xalt/0.6.0/bin/ld: fork: Resource temporarily unavailable

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 44: /xalt_helper_functions.sh: No
such file or directory

Error: Problem invoking pkg-config.

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 44: /xalt_helper_functions.sh: No
such file or directory

Failed to fork - Resource temporarily unavailable

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 48: request_tracing: command not
found

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 48: request_tracing: command not
found

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 55: find_real_command: command
not found

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 55: find_real_command: command
not found

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 60: find_working_python: command
not found

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 60: find_working_python: command
not found

Warning:

Unable to determine ld version.

Default linker script will be used.


Warning:

Unable to determine ld version.

Default linker script will be used.


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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"input/cp_parser_status_types.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/input/'
cp_parser_status_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"mixed_energy_types.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/'
mixed_energy_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"subsys/damping_dipole_types.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/subsys/'
damping_dipole_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"subsys/atprop_types.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/subsys/'
atprop_types.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"subsys/force_field_kind_types.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/subsys/'
force_field_kind_types.F90

make[3]: *** [structure_factor_types.o] Error 1

make[3]: *** Waiting for unfinished jobs....

make[3]: *** [splines.o] Error 1

make[3]: *** [whittaker.o] Error 1

make[3]: *** [cp_parser_inpp_types.o] Error 1

make[3]: *** [shell_potential_types.o] Error 1

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"pw/pw_grid_types.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/pw/'
pw_grid_types.F90

Warning:

Unable to determine ld version.

Default linker script will be used.


/opt/gcc/7.2.0/bin/gfortran: fork: Resource temporarily unavailable

Error: Problem invoking pkg-config.

make[3]: *** [atprop_types.o] Error 1

make[3]: *** [list_callstackentry.o] Error 128

/opt/gcc/7.2.0/bin/gfortran: fork: Resource temporarily unavailable

/home/y07/y07/cse/xalt/0.6.0/bin/ld: fork: Resource temporarily unavailable

/opt/gcc/7.2.0/bin/gfortran: fork: Resource temporarily unavailable

Warning:

Unable to determine ld version.

Default linker script will be used.


make[3]: *** [parallel_rng_types.o] Error 128

make[3]: *** [dict.o] Error 128

/home/y07/y07/cse/xalt/0.6.0/bin/ld: fork: Resource temporarily unavailable

Error: Problem invoking pkg-config.

make[3]: *** [periodic_table.o] Error 1

/usr/bin/dirname: missing operand

Try `/usr/bin/dirname --help' for more information.

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 44: /xalt_helper_functions.sh: No
such file or directory

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 48: request_tracing: command not
found

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"pw/fft/fftw3_lib.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/pw/fft/'
fftw3_lib.F90

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 55: find_real_command: command
not found

/home/y07/y07/cse/xalt/0.6.0/bin/ld: line 60: find_working_python: command
not found

Warning:

Unable to determine ld version.

Default linker script will be used.


/home2/y07/y07/cse/xalt/0.6.0/bin/xalt_helper_functions.sh: fork: Resource
temporarily unavailable

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"pw/fft/mltfftsg_tools.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/pw/fft/'
mltfftsg_tools.F90

sh: fork: Resource temporarily unavailable

Error invoking pkg-config!

make[3]: *** [powell.o] Error 128

Warning:

Unable to determine ld version.

Default linker script will be used.


Error: Problem invoking pkg-config.

make[3]: *** [mltfftsg_tools.o] Error 1

/opt/gcc/7.2.0/bin/gfortran: fork: Resource temporarily unavailable

make[3]: *** [mixed_energy_types.o] Error 128

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"common/list_routinestat.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/common/'
list_routinestat.F90

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-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="\"eslogin005\""
-D__COMPILE_REVISION="\"svn:18464\""
-D__DATA_DIR="\"/work/d167/d167/jinca/Dissertation/Downloads/cp2k/data\""
-D__SHORT_FILE__="\"fm/cp_blacs_calls.F\""
-I'/work/d167/d167/jinca/Dissertation/Downloads/cp2k/src/fm/'
cp_blacs_calls.F90

make[2]: *** [all] Error 2

make[1]: *** [popt] Error 2

make: *** [all] Error 2

jinca at eslogin005
:/work/d167/d167/jinca/Dissertation/Downloads/cp2k/makefiles>

Hope you can guide me with this basic procedure.

Thanks,
Julita

-- 
"Este mensaje y sus anexos van dirigidos exclusivamente a la persona o
 
entidad que se muestra como destinatario/s y pueden contener datos 

personales y/o información confidencial, sometida a secreto profesional o
 
cuya divulgación esté prohibida en la legislación
 vigente. Que 
<http://www.ctic.uni.edu.pe/>da prohibida, toda divulgación, reproducción u 
otra acción 
al respecto por parte de personas o entidades  distintas al 

destinatario/s. Si ha recibido este mensaje por error, por favor, 

contáctenos a la siguiente dirección de correo electrónico
 lp... at uni.edu.pe 
<mailto:lp... at uni.edu.pe> y proceda a su eliminación.



En cumplimiento a 
lo establecido en la Ley de Protección de Datos 
Personales - Ley N° 29733, 
le informamos que sus datos personales 
obtenidos son almacenados bajo la 
confidencialidad y las medidas de 
seguridad legalmente establecidas y no 
serán cedidos ni
 compartidos con empresas ni entidades ajenas a la 
Universidad Nacional 
de Ingeniería. Si lo desea, usted podrá ejercitar los 
derechos de 
actualización, inclusión, rectificación, supresión u 
oposición, enviando
 un mensaje al correo electrónico anteriormente
 
señalado e indicando en el "Asunto" el derecho que desea ejercer"

-- 
"Este mensaje y sus anexos van dirigidos exclusivamente a la persona o
 
entidad que se muestra como destinatario/s y pueden contener datos 

personales y/o información confidencial, sometida a secreto profesional o
 
cuya divulgación esté prohibida en la legislación
 vigente. Que 
<http://www.ctic.uni.edu.pe/>da prohibida, toda divulgación, reproducción u 
otra acción 
al respecto por parte de personas o entidades  distintas al 

destinatario/s. Si ha recibido este mensaje por error, por favor, 

contáctenos a la siguiente dirección de correo electrónico
 lp... at uni.edu.pe 
<mailto:lp... at uni.edu.pe> y proceda a su eliminación.



En cumplimiento a 
lo establecido en la Ley de Protección de Datos 
Personales - Ley N° 29733, 
le informamos que sus datos personales 
obtenidos son almacenados bajo la 
confidencialidad y las medidas de 
seguridad legalmente establecidas y no 
serán cedidos ni
 compartidos con empresas ni entidades ajenas a la 
Universidad Nacional 
de Ingeniería. Si lo desea, usted podrá ejercitar los 
derechos de 
actualización, inclusión, rectificación, supresión u 
oposición, enviando
 un mensaje al correo electrónico anteriormente
 
señalado e indicando en el "Asunto" el derecho que desea ejercer"
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