#!/bin/bash
#SBATCH --account=rrg-jerzy-ab
#SBATCH --nodes=1
#SBATCH --ntasks-per-node=32
#SBATCH --mem=0
#SBATCH --time=03-00:00           # time (DD-HH:MM)

module load  nixpkgs/16.09  gcc/7.3.0  openmpi/3.1.2   quantumespresso/6.4.1

echo "PWscf started at: `date`"
srun  pw.x < scf.in > scf.out
srun  ph.x < ph.in > ph.out

echo "Program finished with exit code $? at: `date`"