#!/bin/bash
#SBATCH --job-name=lammps
#SBATCH --output=lammps

#SBATCH --nodes=1
#SBATCH --tasks-per-node=16
#SBATCH --mem-per-cpu=1800M
#SBATCH --time=24:00:00

module load lammps-omp/20170811

srun -n 16 lmp_icc_openmpi  < inputfile.in

echo "Job finished at `date`"