lammps/bench/KEPLER/run_cpu.sh

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#!/bin/bash
#SBATCH -N 1 --time=12:00:00
mpirun -np 1 lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj
mv log.lammps log.10Sep14.lj.cpu.128K.1
mpirun -np 2 lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj
mv log.lammps log.10Sep14.lj.cpu.128K.2
mpirun -np 4 lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj
mv log.lammps log.10Sep14.lj.cpu.128K.4
mpirun -np 6 lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj
mv log.lammps log.10Sep14.lj.cpu.128K.6
mpirun -np 8 lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj
mv log.lammps log.10Sep14.lj.cpu.128K.8
mpirun -np 10 lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj
mv log.lammps log.10Sep14.lj.cpu.128K.10
mpirun -np 12 lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj
mv log.lammps log.10Sep14.lj.cpu.128K.12
mpirun -np 14 lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj
mv log.lammps log.10Sep14.lj.cpu.128K.14
mpirun -np 16 lmp_cpu -v x 32 -v y 32 -v z 32 -v t 100 < in.lj
mv log.lammps log.10Sep14.lj.cpu.128K.16