#!/usr/bin/env bash

#
SIESTA2BGW="$HOME/BerkeleyGW/bin/siesta2bgw.real.x"

# put argument for number of procs here too if needed, e.g. -n 8
MPIRUN="mpirun"
#
cd ./3-siesta
$MPIRUN $SIESTA2BGW &> ./OUT.siesta2bgw
cd ..
#
