[CP2K-user] Compiling cp2k-6.1

Diego Gomez diego.... at gmail.com
Tue May 18 23:38:14 UTC 2021
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I'm having trouble compiling CP2K-6.1.

I have the arch file and the output of that archfile using:
make -j 20 ARCH=arch VERSION=popt &> make.out

The error that I'm getting that I can't understand is 

ifort: warning #10193: -vec is default; use -x and -ax to configure 
vectorization

I'm not sure how to debug this.


Any help would be greatly appreciated


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# by default some intel compilers put temporaries on the stack
# this might lead to segmentation faults is the stack limit is set to low
# stack limits can be increased by sysadmins or e.g with ulimit -s 256000
# furthermore new ifort (10.0?) compilers support the option
# -heap-arrays 64
# add this to the compilation flags is the other options do not work
# The following settings worked for:
# - AMD64 Opteron
# - SUSE Linux Enterprise Server 10.0 (x86_64)
# - Intel(R) Fortran Compiler for Intel(R) EM64T-based applications, Version 10.0.025
# - AMD acml library version 3.6.0
# - MPICH2-1.0.5p4
# - SCALAPACK library          1.8.0
#
#
CC       = gcc 
CPP      = 
FC       = mpifort
LD       = mpifort
AR       = ar -r

FFTW_INC = /opt/fftw/2.1/opt/include
FFTW_LIB = /opt/fftw/2.1/opt/lib64
LIBXC_INC = /ascldap/users/dtgome/libxc/include
LIBXC_LIB = /ascldap/users/dtgome/libxc/lib
MKL_LIB = /opt/intel/16.0/mkl/lib/intel64

DFLAGS      = -D__F2008 -D__FFTW3 -D__LIBINT -D__MPI_VERSION=3\
              -D__LIBINT_MAX_AM=7 -D__LIBDERIV_MAX_AM1=6 -D__MAX_CONTR=4\
              -D__parallel -D__SCALAPACK -D__LIBXC
CPPFLAGS    =
FCFLAGS = $(DFLAGS) -O2 -ffree-form -ffree-line-length-none\
             -ftree-vectorize -funroll-loops\
             -mtune=native -I$(FFTW_INC) -I$(LIBINT_INC)


#FCFLAGS     = $(DFLAGS) -O2 -xHost -qopenmp \
#             -ftree-vectorize -funroll-loops\
#             -mtune=native -I$(FFTW_INC) -I$(LIBINT_INC) -std=f2008

#FCFLAGS     = $(DFLAGS) -O2 -ffast-math -ffree-form -ffree-line-length-none\
#              -ftree-vectorize -funroll-loops -mtune=native -std=f2008\
#              -I$(FFTW_INC) -I$(LIBXC_INC)


LDFLAGS     = $(FCFLAGS) -L$(LIBXC_LIB) -static -c

LIBS        = -L$(LIBXC_LIB) -lxcf03 -lxc
LIBS        += $(MKL_LIB)/libmkl_gf_lp64.a\
		$(MKL_LIB)/libmkl_scalapack_lp64.a\
		$(MKL_LIB)/libmkl_blacs_openmpi_lp64.a\
              	$(MKL_LIB)/libmkl_sequential.a\
              	$(MKL_LIB)/libmkl_core.a\
              $(FFTW_LIB)/libfftw.a\
              $(LIBXC_LIB)/libxcf90.a\
              -ldl
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Discovering programs ...
Removing stale archives for popt ... 
Resolving dependencies for popt ... 
mpifort -D__F2008 -D__FFTW3 -D__LIBINT -D__MPI_VERSION=3 -D__LIBINT_MAX_AM=7 -D__LIBDERIV_MAX_AM1=6 -D__MAX_CONTR=4 -D__parallel -D__SCALAPACK -D__LIBXC -O2 -ffree-form -ffree-line-length-none -ftree-vectorize -funroll-loops -mtune=native -I/opt/fftw/2.1/opt/include -I -D__COMPILE_ARCH="\"solonewarch\"" -D__COMPILE_DATE="\"Tue May 18 17:19:42 MDT 2021\"" -D__COMPILE_HOST="\"solo-login2\"" -D__COMPILE_REVISION="\"svn:18464\"" -D__DATA_DIR="\"/ascldap/users/dtgome/cp2k-6.1/data\"" -L/ascldap/users/dtgome/libxc/lib -static -c -L/ascldap/users/dtgome/cp2k-6.1/lib/solonewarch/popt -o /ascldap/users/dtgome/cp2k-6.1/exe/solonewarch/graph.popt graph.o  -lcp2kmetadyn_tools -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/ascldap/users/dtgome/libxc/lib -lxcf03 -lxc /opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a /opt/intel/16.0/mkl/lib/intel64/libmkl_core.a /opt/fftw/2.1/opt/lib64/libfftw.a /ascldap/users/dtgome/libxc/lib/libxcf90.a -ldl
mpifort -D__F2008 -D__FFTW3 -D__LIBINT -D__MPI_VERSION=3 -D__LIBINT_MAX_AM=7 -D__LIBDERIV_MAX_AM1=6 -D__MAX_CONTR=4 -D__parallel -D__SCALAPACK -D__LIBXC -O2 -ffree-form -ffree-line-length-none -ftree-vectorize -funroll-loops -mtune=native -I/opt/fftw/2.1/opt/include -I -D__COMPILE_ARCH="\"solonewarch\"" -D__COMPILE_DATE="\"Tue May 18 17:19:42 MDT 2021\"" -D__COMPILE_HOST="\"solo-login2\"" -D__COMPILE_REVISION="\"svn:18464\"" -D__DATA_DIR="\"/ascldap/users/dtgome/cp2k-6.1/data\"" -L/ascldap/users/dtgome/libxc/lib -static -c -L/ascldap/users/dtgome/cp2k-6.1/lib/solonewarch/popt -o /ascldap/users/dtgome/cp2k-6.1/exe/solonewarch/dbcsr_performance_driver.popt dbcsr_performance_driver.o  -ldbcsr -ldbcsrmm -ldbcsrops -ldbcsrbblock -ldbcsrbdist -ldbcsrbase -ldbcsrdata -lcp2kmpiwrap -lmicsmm -lclsmm -lcp2kacc -lcp2kaccmic -lcp2kaccopencl -lcp2kbase -L/ascldap/users/dtgome/libxc/lib -lxcf03 -lxc /opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a /opt/intel/16.0/mkl/lib/intel64/libmkl_core.a /opt/fftw/2.1/opt/lib64/libfftw.a /ascldap/users/dtgome/libxc/lib/libxcf90.a -ldl
mpifort -D__F2008 -D__FFTW3 -D__LIBINT -D__MPI_VERSION=3 -D__LIBINT_MAX_AM=7 -D__LIBDERIV_MAX_AM1=6 -D__MAX_CONTR=4 -D__parallel -D__SCALAPACK -D__LIBXC -O2 -ffree-form -ffree-line-length-none -ftree-vectorize -funroll-loops -mtune=native -I/opt/fftw/2.1/opt/include -I -D__COMPILE_ARCH="\"solonewarch\"" -D__COMPILE_DATE="\"Tue May 18 17:19:42 MDT 2021\"" -D__COMPILE_HOST="\"solo-login2\"" -D__COMPILE_REVISION="\"svn:18464\"" -D__DATA_DIR="\"/ascldap/users/dtgome/cp2k-6.1/data\"" -L/ascldap/users/dtgome/libxc/lib -static -c -L/ascldap/users/dtgome/cp2k-6.1/lib/solonewarch/popt -o /ascldap/users/dtgome/cp2k-6.1/exe/solonewarch/dbcsr_unittest.popt dbcsr_unittest.o  -ldbcsr -ldbcsrmm -ldbcsrops -ldbcsrbblock -ldbcsrbdist -ldbcsrbase -ldbcsrdata -lcp2kmpiwrap -lmicsmm -lclsmm -lcp2kacc -lcp2kaccmic -lcp2kaccopencl -lcp2kbase -L/ascldap/users/dtgome/libxc/lib -lxcf03 -lxc /opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a /opt/intel/16.0/mkl/lib/intel64/libmkl_core.a /opt/fftw/2.1/opt/lib64/libfftw.a /ascldap/users/dtgome/libxc/lib/libxcf90.a -ldl
mpifort -D__F2008 -D__FFTW3 -D__LIBINT -D__MPI_VERSION=3 -D__LIBINT_MAX_AM=7 -D__LIBDERIV_MAX_AM1=6 -D__MAX_CONTR=4 -D__parallel -D__SCALAPACK -D__LIBXC -O2 -ffree-form -ffree-line-length-none -ftree-vectorize -funroll-loops -mtune=native -I/opt/fftw/2.1/opt/include -I -D__COMPILE_ARCH="\"solonewarch\"" -D__COMPILE_DATE="\"Tue May 18 17:19:42 MDT 2021\"" -D__COMPILE_HOST="\"solo-login2\"" -D__COMPILE_REVISION="\"svn:18464\"" -D__DATA_DIR="\"/ascldap/users/dtgome/cp2k-6.1/data\"" -L/ascldap/users/dtgome/libxc/lib -static -c -L/ascldap/users/dtgome/cp2k-6.1/lib/solonewarch/popt -o /ascldap/users/dtgome/cp2k-6.1/exe/solonewarch/dbcsr_example_1.popt dbcsr_example_1.o  -ldbcsr -ldbcsrmm -ldbcsrops -ldbcsrbblock -ldbcsrbdist -ldbcsrbase -ldbcsrdata -lcp2kmpiwrap -lmicsmm -lclsmm -lcp2kacc -lcp2kaccmic -lcp2kaccopencl -lcp2kbase -L/ascldap/users/dtgome/libxc/lib -lxcf03 -lxc /opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a /opt/intel/16.0/mkl/lib/intel64/libmkl_core.a /opt/fftw/2.1/opt/lib64/libfftw.a /ascldap/users/dtgome/libxc/lib/libxcf90.a -ldl
mpifort -D__F2008 -D__FFTW3 -D__LIBINT -D__MPI_VERSION=3 -D__LIBINT_MAX_AM=7 -D__LIBDERIV_MAX_AM1=6 -D__MAX_CONTR=4 -D__parallel -D__SCALAPACK -D__LIBXC -O2 -ffree-form -ffree-line-length-none -ftree-vectorize -funroll-loops -mtune=native -I/opt/fftw/2.1/opt/include -I -D__COMPILE_ARCH="\"solonewarch\"" -D__COMPILE_DATE="\"Tue May 18 17:19:42 MDT 2021\"" -D__COMPILE_HOST="\"solo-login2\"" -D__COMPILE_REVISION="\"svn:18464\"" -D__DATA_DIR="\"/ascldap/users/dtgome/cp2k-6.1/data\"" -L/ascldap/users/dtgome/libxc/lib -static -c -L/ascldap/users/dtgome/cp2k-6.1/lib/solonewarch/popt -o /ascldap/users/dtgome/cp2k-6.1/exe/solonewarch/dbcsr_example_2.popt dbcsr_example_2.o  -ldbcsr -ldbcsrmm -ldbcsrops -ldbcsrbblock -ldbcsrbdist -ldbcsrbase -ldbcsrdata -lcp2kmpiwrap -lmicsmm -lclsmm -lcp2kacc -lcp2kaccmic -lcp2kaccopencl -lcp2kbase -L/ascldap/users/dtgome/libxc/lib -lxcf03 -lxc /opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a /opt/intel/16.0/mkl/lib/intel64/libmkl_core.a /opt/fftw/2.1/opt/lib64/libfftw.a /ascldap/users/dtgome/libxc/lib/libxcf90.a -ldl
mpifort -D__F2008 -D__FFTW3 -D__LIBINT -D__MPI_VERSION=3 -D__LIBINT_MAX_AM=7 -D__LIBDERIV_MAX_AM1=6 -D__MAX_CONTR=4 -D__parallel -D__SCALAPACK -D__LIBXC -O2 -ffree-form -ffree-line-length-none -ftree-vectorize -funroll-loops -mtune=native -I/opt/fftw/2.1/opt/include -I -D__COMPILE_ARCH="\"solonewarch\"" -D__COMPILE_DATE="\"Tue May 18 17:19:42 MDT 2021\"" -D__COMPILE_HOST="\"solo-login2\"" -D__COMPILE_REVISION="\"svn:18464\"" -D__DATA_DIR="\"/ascldap/users/dtgome/cp2k-6.1/data\"" -L/ascldap/users/dtgome/libxc/lib -static -c -L/ascldap/users/dtgome/cp2k-6.1/lib/solonewarch/popt -o /ascldap/users/dtgome/cp2k-6.1/exe/solonewarch/dbcsr_example_3.popt dbcsr_example_3.o  -ldbcsr -ldbcsrmm -ldbcsrops -ldbcsrbblock -ldbcsrbdist -ldbcsrbase -ldbcsrdata -lcp2kmpiwrap -lmicsmm -lclsmm -lcp2kacc -lcp2kaccmic -lcp2kaccopencl -lcp2kbase -L/ascldap/users/dtgome/libxc/lib -lxcf03 -lxc /opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a /opt/intel/16.0/mkl/lib/intel64/libmkl_core.a /opt/fftw/2.1/opt/lib64/libfftw.a /ascldap/users/dtgome/libxc/lib/libxcf90.a -ldl
mpifort -D__F2008 -D__FFTW3 -D__LIBINT -D__MPI_VERSION=3 -D__LIBINT_MAX_AM=7 -D__LIBDERIV_MAX_AM1=6 -D__MAX_CONTR=4 -D__parallel -D__SCALAPACK -D__LIBXC -O2 -ffree-form -ffree-line-length-none -ftree-vectorize -funroll-loops -mtune=native -I/opt/fftw/2.1/opt/include -I -D__COMPILE_ARCH="\"solonewarch\"" -D__COMPILE_DATE="\"Tue May 18 17:19:42 MDT 2021\"" -D__COMPILE_HOST="\"solo-login2\"" -D__COMPILE_REVISION="\"svn:18464\"" -D__DATA_DIR="\"/ascldap/users/dtgome/cp2k-6.1/data\"" -L/ascldap/users/dtgome/libxc/lib -static -c -L/ascldap/users/dtgome/cp2k-6.1/lib/solonewarch/popt -o /ascldap/users/dtgome/cp2k-6.1/exe/solonewarch/dbcsr_test_csr_conversions.popt dbcsr_test_csr_conversions.o  -ldbcsr -ldbcsrmm -ldbcsrops -ldbcsrbblock -ldbcsrbdist -ldbcsrbase -ldbcsrdata -lcp2kmpiwrap -lmicsmm -lclsmm -lcp2kacc -lcp2kaccmic -lcp2kaccopencl -lcp2kbase -L/ascldap/users/dtgome/libxc/lib -lxcf03 -lxc /opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a /opt/intel/16.0/mkl/lib/intel64/libmkl_core.a /opt/fftw/2.1/opt/lib64/libfftw.a /ascldap/users/dtgome/libxc/lib/libxcf90.a -ldl
ifort: command line warning #10006: ignoring unknown option '-ffree-form'
ifort: command line warning #10006: ignoring unknown option '-ffree-line-length-none'
ifort: warning #10193: -vec is default; use -x and -ax to configure vectorization
ifort: warning #10145: no action performed for file 'graph.o'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_core.a'
ifort: warning #10145: no action performed for file '/opt/fftw/2.1/opt/lib64/libfftw.a'
ifort: warning #10145: no action performed for file '/ascldap/users/dtgome/libxc/lib/libxcf90.a'
mpifort -D__F2008 -D__FFTW3 -D__LIBINT -D__MPI_VERSION=3 -D__LIBINT_MAX_AM=7 -D__LIBDERIV_MAX_AM1=6 -D__MAX_CONTR=4 -D__parallel -D__SCALAPACK -D__LIBXC -O2 -ffree-form -ffree-line-length-none -ftree-vectorize -funroll-loops -mtune=native -I/opt/fftw/2.1/opt/include -I -D__COMPILE_ARCH="\"solonewarch\"" -D__COMPILE_DATE="\"Tue May 18 17:19:42 MDT 2021\"" -D__COMPILE_HOST="\"solo-login2\"" -D__COMPILE_REVISION="\"svn:18464\"" -D__DATA_DIR="\"/ascldap/users/dtgome/cp2k-6.1/data\"" -L/ascldap/users/dtgome/libxc/lib -static -c -L/ascldap/users/dtgome/cp2k-6.1/lib/solonewarch/popt -o /ascldap/users/dtgome/cp2k-6.1/exe/solonewarch/cp2k.popt cp2k.o  -lcp2kstart -lcp2kmc -lcp2kswarm -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2ktmc -lcp2kmain -lcp2kgrid -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kdbcsr_tensor -ldbcsr -ldbcsrmm -ldbcsrops -ldbcsrbblock -ldbcsrbdist -ldbcsrbase -ldbcsrdata -lmicsmm -lclsmm -lcp2kacc -lcp2kaccmic -lcp2kaccopencl -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/ascldap/users/dtgome/libxc/lib -lxcf03 -lxc /opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a /opt/intel/16.0/mkl/lib/intel64/libmkl_core.a /opt/fftw/2.1/opt/lib64/libfftw.a /ascldap/users/dtgome/libxc/lib/libxcf90.a -ldl
mpifort -D__F2008 -D__FFTW3 -D__LIBINT -D__MPI_VERSION=3 -D__LIBINT_MAX_AM=7 -D__LIBDERIV_MAX_AM1=6 -D__MAX_CONTR=4 -D__parallel -D__SCALAPACK -D__LIBXC -O2 -ffree-form -ffree-line-length-none -ftree-vectorize -funroll-loops -mtune=native -I/opt/fftw/2.1/opt/include -I -D__COMPILE_ARCH="\"solonewarch\"" -D__COMPILE_DATE="\"Tue May 18 17:19:42 MDT 2021\"" -D__COMPILE_HOST="\"solo-login2\"" -D__COMPILE_REVISION="\"svn:18464\"" -D__DATA_DIR="\"/ascldap/users/dtgome/cp2k-6.1/data\"" -L/ascldap/users/dtgome/libxc/lib -static -c -L/ascldap/users/dtgome/cp2k-6.1/lib/solonewarch/popt -o /ascldap/users/dtgome/cp2k-6.1/exe/solonewarch/cp2k_shell.popt cp2k_shell.o  -lcp2kstart -lcp2kmc -lcp2kswarm -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2ktmc -lcp2kmain -lcp2kgrid -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kdbcsr_tensor -ldbcsr -ldbcsrmm -ldbcsrops -ldbcsrbblock -ldbcsrbdist -ldbcsrbase -ldbcsrdata -lmicsmm -lclsmm -lcp2kacc -lcp2kaccmic -lcp2kaccopencl -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/ascldap/users/dtgome/libxc/lib -lxcf03 -lxc /opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a /opt/intel/16.0/mkl/lib/intel64/libmkl_core.a /opt/fftw/2.1/opt/lib64/libfftw.a /ascldap/users/dtgome/libxc/lib/libxcf90.a -ldl
mpifort -D__F2008 -D__FFTW3 -D__LIBINT -D__MPI_VERSION=3 -D__LIBINT_MAX_AM=7 -D__LIBDERIV_MAX_AM1=6 -D__MAX_CONTR=4 -D__parallel -D__SCALAPACK -D__LIBXC -O2 -ffree-form -ffree-line-length-none -ftree-vectorize -funroll-loops -mtune=native -I/opt/fftw/2.1/opt/include -I -D__COMPILE_ARCH="\"solonewarch\"" -D__COMPILE_DATE="\"Tue May 18 17:19:42 MDT 2021\"" -D__COMPILE_HOST="\"solo-login2\"" -D__COMPILE_REVISION="\"svn:18464\"" -D__DATA_DIR="\"/ascldap/users/dtgome/cp2k-6.1/data\"" -L/ascldap/users/dtgome/libxc/lib -static -c  -L/ascldap/users/dtgome/cp2k-6.1/lib/solonewarch/popt -o /ascldap/users/dtgome/cp2k-6.1/exe/solonewarch/libcp2k_unittest.popt libcp2k_unittest.o  -lcp2kstart -lcp2kmc -lcp2kswarm -lcp2kmotion -lcp2kthermostat -lcp2kemd -lcp2ktmc -lcp2kmain -lcp2kgrid -ldbcsrarnoldi -ldbcsrx -lcp2kshg_int -lcp2keri_mme -lcp2kminimax -lcp2khfxbase -lcp2ksubsys -lcp2kxc -lcp2kao -lcp2kinput -lcp2kpw -lcp2kfft -lcp2kdbcsr_tensor -ldbcsr -ldbcsrmm -ldbcsrops -ldbcsrbblock -ldbcsrbdist -ldbcsrbase -ldbcsrdata -lmicsmm -lclsmm -lcp2kacc -lcp2kaccmic -lcp2kaccopencl -lcp2kfm -lcp2kcommon -lcp2kmpiwrap -lcp2kbase -L/ascldap/users/dtgome/libxc/lib -lxcf03 -lxc /opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a /opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a /opt/intel/16.0/mkl/lib/intel64/libmkl_core.a /opt/fftw/2.1/opt/lib64/libfftw.a /ascldap/users/dtgome/libxc/lib/libxcf90.a -ldl
ifort: command line warning #10006: ignoring unknown option '-ffree-form'
ifort: command line warning #10006: ignoring unknown option '-ffree-line-length-none'
ifort: command line warning #10006: ignoring unknown option '-ffree-form'
ifort: command line warning #10006: ignoring unknown option '-ffree-line-length-none'
ifort: command line warning #10006: ignoring unknown option '-ffree-form'
ifort: command line warning #10006: ignoring unknown option '-ffree-form'
ifort: command line warning #10006: ignoring unknown option '-ffree-line-length-none'
ifort: command line warning #10006: ignoring unknown option '-ffree-line-length-none'
ifort: warning #10193: -vec is default; use -x and -ax to configure vectorization
ifort: warning #10193: -vec is default; use -x and -ax to configure vectorization
ifort: warning #10145: no action performed for file 'dbcsr_unittest.o'
ifort: warning #10145: no action performed for file 'dbcsr_performance_driver.o'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_core.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_core.a'
ifort: warning #10145: no action performed for file '/opt/fftw/2.1/opt/lib64/libfftw.a'
ifort: warning #10145: no action performed for file '/opt/fftw/2.1/opt/lib64/libfftw.a'
ifort: warning #10145: no action performed for file '/ascldap/users/dtgome/libxc/lib/libxcf90.a'
ifort: warning #10145: no action performed for file '/ascldap/users/dtgome/libxc/lib/libxcf90.a'
ifort: warning #10193: -vec is default; use -x and -ax to configure vectorization
ifort: warning #10193: -vec is default; use -x and -ax to configure vectorization
ifort: warning #10145: no action performed for file 'dbcsr_example_1.o'
ifort: warning #10145: no action performed for file 'dbcsr_example_2.o'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_core.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_core.a'
ifort: warning #10145: no action performed for file '/opt/fftw/2.1/opt/lib64/libfftw.a'
ifort: warning #10145: no action performed for file '/opt/fftw/2.1/opt/lib64/libfftw.a'
ifort: warning #10145: no action performed for file '/ascldap/users/dtgome/libxc/lib/libxcf90.a'
ifort: warning #10145: no action performed for file '/ascldap/users/dtgome/libxc/lib/libxcf90.a'
ifort: command line warning #10006: ignoring unknown option '-ffree-form'
ifort: command line warning #10006: ignoring unknown option '-ffree-line-length-none'
ifort: command line warning #10006: ignoring unknown option '-ffree-form'
ifort: command line warning #10006: ignoring unknown option '-ffree-form'
ifort: command line warning #10006: ignoring unknown option '-ffree-line-length-none'
ifort: command line warning #10006: ignoring unknown option '-ffree-line-length-none'
ifort: warning #10193: -vec is default; use -x and -ax to configure vectorization
ifort: warning #10145: no action performed for file 'cp2k_shell.o'
ifort: warning #10193: -vec is default; use -x and -ax to configure vectorization
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a'
ifort: warning #10193: -vec is default; use -x and -ax to configure vectorization
ifort: warning #10145: no action performed for file 'cp2k.o'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a'
ifort: warning #10145: no action performed for file 'libcp2k_unittest.o'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_core.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a'
ifort: warning #10145: no action performed for file '/opt/fftw/2.1/opt/lib64/libfftw.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_core.a'
ifort: warning #10145: no action performed for file '/ascldap/users/dtgome/libxc/lib/libxcf90.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a'
ifort: warning #10145: no action performed for file '/opt/fftw/2.1/opt/lib64/libfftw.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_core.a'
ifort: warning #10145: no action performed for file '/opt/fftw/2.1/opt/lib64/libfftw.a'
ifort: warning #10145: no action performed for file '/ascldap/users/dtgome/libxc/lib/libxcf90.a'
ifort: warning #10145: no action performed for file '/ascldap/users/dtgome/libxc/lib/libxcf90.a'
ifort: command line warning #10006: ignoring unknown option '-ffree-form'
ifort: command line warning #10006: ignoring unknown option '-ffree-line-length-none'
ifort: command line warning #10006: ignoring unknown option '-ffree-form'
ifort: command line warning #10006: ignoring unknown option '-ffree-line-length-none'
ifort: warning #10193: -vec is default; use -x and -ax to configure vectorization
ifort: warning #10145: no action performed for file 'dbcsr_example_3.o'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_core.a'
ifort: warning #10145: no action performed for file '/opt/fftw/2.1/opt/lib64/libfftw.a'
ifort: warning #10193: -vec is default; use -x and -ax to configure vectorization
ifort: warning #10145: no action performed for file '/ascldap/users/dtgome/libxc/lib/libxcf90.a'
ifort: warning #10145: no action performed for file 'dbcsr_test_csr_conversions.o'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_gf_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_scalapack_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_sequential.a'
ifort: warning #10145: no action performed for file '/opt/intel/16.0/mkl/lib/intel64/libmkl_core.a'
ifort: warning #10145: no action performed for file '/opt/fftw/2.1/opt/lib64/libfftw.a'
ifort: warning #10145: no action performed for file '/ascldap/users/dtgome/libxc/lib/libxcf90.a'
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