eea786f4e8
- remove the old LGPL license headers from all files in Spack - add SPDX headers to all files - core and most packages are (Apache-2.0 OR MIT) - a very small number of remaining packages are LGPL-2.1-only
33 lines
1011 B
Python
33 lines
1011 B
Python
# Copyright 2013-2018 Lawrence Livermore National Security, LLC and other
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# Spack Project Developers. See the top-level COPYRIGHT file for details.
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#
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# SPDX-License-Identifier: (Apache-2.0 OR MIT)
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from spack import *
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class AtomDft(MakefilePackage):
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"""ATOM is a program for DFT calculations in atoms and pseudopotential
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generation."""
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homepage = "https://departments.icmab.es/leem/siesta/Pseudopotentials/"
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url = "https://departments.icmab.es/leem/siesta/Pseudopotentials/Code/atom-4.2.6.tgz"
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version('4.2.6', 'c0c80cf349f951601942ed6c7cb0256b')
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depends_on('libgridxc')
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depends_on('xmlf90')
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def edit(self, spec, prefix):
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copy('arch.make.sample', 'arch.make')
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@property
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def build_targets(self):
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return ['XMLF90_ROOT=%s' % self.spec['xmlf90'].prefix,
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'GRIDXC_ROOT=%s' % self.spec['libgridxc'].prefix,
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'FC=fc']
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def install(self, spec, prefix):
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mkdir(prefix.bin)
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install('atm', prefix.bin)
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