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submit_abe_all.sh
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Thu, Aug 22, 14:17
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text/x-shellscript
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Sat, Aug 24, 14:17 (2 d)
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rLAMMPS lammps
submit_abe_all.sh
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#!/bin/sh
#PBS -A <project>
#PBS -q normal
#PBS -N gb-all
#PBS -l nodes=16:ppn=8
#PBS -j oe
#PBS -l walltime=06:00:00
set -v
set -x
cd $PBS_O_WORKDIR
mpirun=/usr/local/openmpi-1.3.2-gnu/bin/mpirun
$mpirun -npernode 7 -x OMP_NUM_THREADS=1 ./lmp_abe -in in.gb-cpu -var len 40.0 -log log.gb-cpu-7m1t
$mpirun -npernode 7 -x OMP_NUM_THREADS=1 ./lmp_abe -in in.gb-omp -var len 40.0 -log log.gb-omp-7m1t
$mpirun -npernode 4 -x OMP_NUM_THREADS=1 ./lmp_abe -in in.gb-cpu -var len 40.0 -log log.gb-cpu-4m1t
$mpirun -npernode 4 -x OMP_NUM_THREADS=2 ./lmp_abe -in in.gb-omp -var len 40.0 -log log.gb-omp-4m2t
$mpirun -npernode 2 -x OMP_NUM_THREADS=1 ./lmp_abe -in in.gb-cpu -var len 40.0 -log log.gb-cpu-2m1t
$mpirun -npernode 2 -x OMP_NUM_THREADS=4 ./lmp_abe -in in.gb-omp -var len 40.0 -log log.gb-omp-2m4t
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