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##############################################################################
# Copyright (c) 2013-2018, Lawrence Livermore National Security, LLC.
# Produced at the Lawrence Livermore National Laboratory.
#
# This file is part of Spack.
# Created by Todd Gamblin, tgamblin@llnl.gov, All rights reserved.
# LLNL-CODE-647188
#
# For details, see https://github.com/spack/spack
# Please also see the NOTICE and LICENSE files for our notice and the LGPL.
#
# This program is free software; you can redistribute it and/or modify
# it under the terms of the GNU Lesser General Public License (as
# published by the Free Software Foundation) version 2.1, February 1999.
#
# This program is distributed in the hope that it will be useful, but
# WITHOUT ANY WARRANTY; without even the IMPLIED WARRANTY OF
# MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the terms and
# conditions of the GNU Lesser General Public License for more details.
#
# You should have received a copy of the GNU Lesser General Public
# License along with this program; if not, write to the Free Software
# Foundation, Inc., 59 Temple Place, Suite 330, Boston, MA 02111-1307 USA
##############################################################################
from spack import *
import shutil
class Libgridxc(Package):
"""A library to compute the exchange and correlation energy and potential
in spherical (i.e. an atom) or periodic systems."""
homepage = "https://launchpad.net/libgridxc"
url = "https://launchpad.net/libgridxc/trunk/0.7/+download/libgridxc-0.7.6.tgz"
version('0.7.6', 'a593f845d7565a168f1cf515a0a89879')
phases = ['configure', 'install']
def configure(self, spec, prefix):
sh = which('sh')
with working_dir('build', create=True):
sh('../src/config.sh')
shutil.copyfile('../extra/fortran.mk', 'fortran.mk')
def install(self, spec, prefix):
with working_dir('build'):
make('PREFIX=%s' % self.prefix, 'FC=fc')
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