| 3:26:19 PM PDT - Sat, Apr 11th 2015 |
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Dear Developer
I was trying to compile the develop version of 2015-02-24 with intel 15.0.2 and mopish-3.1.4.
The compilation fail at ccsd_t_kernels_omp.F with error messages like "
ifort -c -i8 -align -qopt-report-file=stderr -fimf-arch-consistency=true -O3 -unroll -ip -xHost -I. -I../include -I/home/jtravers/Work/sw/nwchem/src/include -I/home/jtravers/Work/sw/nwchem/src/tools/install/include -DEXT_INT -DLINUX -DLINUX64 -DIFCV8 -DIFCLINUX -DSCALAPACK -DPARALLEL_DIAG -DDEBUG_PRINT ccsd_t_kernels_omp.F
/tmp/ifortFoKZpL.i: catastrophic error: **Internal compiler error: segmentation violation signal raised** Please report this error along with the circumstances in which it occurred in a Software Problem Report. Note: File and line given may not be explicit cause of this error.
compilation aborted for ccsd_t_kernels_omp.F (code 1)
make[3]: *** [/home/jtravers/Work/sw/nwchem/lib/LINUX64/libtce.a(ccsd_t_kernels_omp.o)] Error 1
make[3]: *** Waiting for unfinished jobs....
Any suggestions? Thank you!
Here is the environmental variables
xport NWCHEM_TARGET=LINUX64
export F77=ifort
export CC=icc
export FC=ifort
export CXX=icpc
export LARGE_FILES=TRUE
export USE_NOFSCHECK=TRUE
export NWCHEM_LONG_PATHS=Y
export USE_NOFSCHECK=Y
- export CCSDTQ=y
- export CCSDTLR=y
export MRCC_THEORY=TRUE
export NWCHEM_TOP=/home/jtravers/Work/sw/nwchem
export NWCHEM_TARGET=LINUX64
export NWCHEM_MODULES="all python"
export USE_MPI=y
export USE_MPIF=y
export USE_MPIF4=y
export MPI_LOC=/opt/apps/mpi/mpich/mpich-3.1.4-intel-15.0.2
export MPI_LIB=$MPI_LOC/lib
export MPI_INCLUDE=$MPI_LOC/include
export LIBMPI="-lmpifort -Wl,-rpath -Wl,/opt/apps/mpi/mpich/mpich-3.1.4-intel-15.0.2/lib -Wl,--enable-new-dtags -lmpi"
export MSG_COMMS=MPI
export ARMCI_NETWORK=MPI-TS
export PYTHONHOME=/opt/apps/python/Python-2.7.7-gcc-4.8.2
export PYTHONVERSION=2.7
export PYTHON_EXE=/opt/apps/python/Python-2.7.7-gcc-4.8.2/bin/python
export MKLROOT=/opt/apps/intel/Xe2015Update2/composer_xe_2015.2.164/mkl/lib/intel64
export LAPACK_LIB="-L$MKLROOT -lmkl_intel_ilp64 -lmkl_sequential -lmkl_core -lpthread -lm"
export BLAS_LIB="$LAPACK_LIB"
export BLASOPT="$LAPACK_LIB"
export SCALAPACK_LIB="-L$MKLROOT -lmkl_scalapack_ilp64 -lmkl_blacs_intelmpi_ilp64 -lmkl_intel_ilp64 -lmkl_sequential -lmkl_core -lpthread -lm"
export SCALAPACK="$SCALAPACK_LIB"
export USE_SCALAPACK=y
export SCALAPACK_SIZE=8
export BLAS_SIZE=8
export LAPACK_SIZE=8
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