submit-melt.sh
006d63d78a92efficient_neuronet

submit-melt.sh
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			#!/bin/sh

			# user config
			lmp=/home/peter/Repository/lammps-awesome/src/lmp_openmpi-omp
			job=melt
			##################

			for m in 2 4 8 ; do \
			mpirun -x OMP_NUM_THREADS=1 --mca mpi_paffinity_alone 1 -npernode ${m} ${lmp} -in in.${job} -log log.${job}-${m}m-plain
			mpirun -x OMP_NUM_THREADS=1 --mca mpi_paffinity_alone 1 -npernode ${m} ${lmp} -in in.${job}-omp -log log.${job}-${m}m-1t
			done
			m=4; t=2;
			mpirun -x OMP_NUM_THREADS=${t} --mca mpi_paffinity_alone 0 -npernode ${m} ${lmp} -in in.${job}-omp -log log.${job}-${m}m-${t}t
			m=2; t=2;
			mpirun -x OMP_NUM_THREADS=${t} --mca mpi_paffinity_alone 0 -npernode ${m} ${lmp} -in in.${job}-omp -log log.${job}-${m}m-${t}t
			m=2; t=4;
			mpirun -x OMP_NUM_THREADS=${t} --mca mpi_paffinity_alone 0 -npernode ${m} ${lmp} -in in.${job}-omp -log log.${job}-${m}m-${t}t
			m=1; t=2;
			mpirun -x OMP_NUM_THREADS=${t} --mca mpi_paffinity_alone 0 -npernode ${m} ${lmp} -in in.${job}-omp -log log.${job}-${m}m-${t}t
			m=1; t=4;
			mpirun -x OMP_NUM_THREADS=${t} --mca mpi_paffinity_alone 0 -npernode ${m} ${lmp} -in in.${job}-omp -log log.${job}-${m}m-${t}t
			m=1; t=8;
			mpirun -x OMP_NUM_THREADS=${t} --mca mpi_paffinity_alone 0 -npernode ${m} ${lmp} -in in.${job}-omp -log log.${job}-${m}m-${t}t