#!/bin/bash
#SBATCH -J LAMMPS-5May20-case
#SBATCH --ntasks-per-node=8
#SBATCH --nodes=1
#SBATCH --time=10:00

module load lammps/20200505-intel

echo "Running lammps with" $SLURM_NPROCS "MPI tasks"

srun lmp < calc_fcc.in