#!/bin/bash

#SBATCH -o _out.%j.log
#SBATCH -e _err.%j.log

#unlimit memory
ulimit -s unlimited
ulimit -l unlimited

# load path
source /data/intel/oneapi/setvars.sh

cd $SLURM_SUBMIT_DIR

mpirun -np 4  /data/software/vasp.5.4.4/bin/vasp_std > out
