quantum-espresso/test-suite/run-all_currents.x

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#!/bin/bash
#
# Copyright (C) 2001 Quantum ESPRESSO
#
# This program is free software; you can redistribute it and/or
# modify it under the terms of the GNU General Public License
# as published by the Free Software Foundation; either version 2
# of the License. See the file `License' in the root directory
# of the present distribution.
if [[ "$QE_USE_MPI" != "" ]]; then
export PARA_PREFIX="mpirun -np $QE_USE_MPI"
#
# available flags:
# -ni n number of images (or -nimage)
# (only for NEB; for PHonon, see below)
# -nk n number of pools (or -npool, -npools)
# -nb n number of band groups (or -nbgrp,-nband_group)
# -nt n number of task groups (or -ntg, -ntask_groups)
# -nd n number of processors for linear algebra
# (or -ndiag, -northo)
#
export PARA_POSTFIX=" -nk 1 -nd 1 -nb 1 -nt 1 "
else
unset PARA_PREFIX
unset PARA_POSTFIX
fi
echo ' RUNNING ',"${PARA_PREFIX} ${ESPRESSO_ROOT}/bin/all_currents.x ${PARA_POSTFIX} -input $1 > $2 2> $3"
${PARA_PREFIX} ${ESPRESSO_ROOT}/bin/all_currents.x ${PARA_POSTFIX} -input $1 > $2 2> $3
rm -f input_tmp.in