Impi+omp.conf: Difference between revisions
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# | # | ||
# define the commands that run vasp_std, vasp_ncl, and vasp_gam | # define the commands that run vasp_std, vasp_ncl, and vasp_gam | ||
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export VASP_TESTSUITE_EXE_NCL="mpirun $mpi $omp $PWD/../bin/vasp_ncl" | export VASP_TESTSUITE_EXE_NCL="mpirun $mpi $omp $PWD/../bin/vasp_ncl" | ||
export VASP_TESTSUITE_EXE_GAM="mpirun $mpi $omp $PWD/../bin/vasp_gam" | export VASP_TESTSUITE_EXE_GAM="mpirun $mpi $omp $PWD/../bin/vasp_gam" | ||
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Latest revision as of 15:35, 3 February 2020
# # define the commands that run vasp_std, vasp_ncl, and vasp_gam # nthrds=4 nranks=2 mpi="-np $nranks -ppn $nranks" omp="-genv OMP_NUM_THREADS=$nthrds -genv OMP_STACKSIZE=512m" export VASP_TESTSUITE_EXE_STD="mpirun $mpi $omp $PWD/../bin/vasp_std" export VASP_TESTSUITE_EXE_NCL="mpirun $mpi $omp $PWD/../bin/vasp_ncl" export VASP_TESTSUITE_EXE_GAM="mpirun $mpi $omp $PWD/../bin/vasp_gam"