37b1bc9c26
* Add package file for xtb and py-xtb
* Retain maintainers from PythonPackage
* Update package files
- use extends("python") instead of tampering with PYTHONPATH
- use PyPI for downloading sdist of py-xtb
- add simple-dftd3 0.7.0
- add dftd4 3.5.0
- remove --wrap-mode=nodownload from toml-f
* Remove logic for download URL
43 lines
1.5 KiB
Python
43 lines
1.5 KiB
Python
# Copyright 2013-2021 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.package import *
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class SimpleDftd3(MesonPackage):
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"""
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Simple reimplementation of the DFT-D3 dispersion correction
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"""
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homepage = "https://dftd3.readthedocs.io"
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url = "https://github.com/dftd3/simple-dftd3/releases/download/v0.7.0/s-dftd3-0.7.0-source.tar.xz"
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git = "https://github.com/dftd3/simple-dftd3.git"
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maintainers = ["awvwgk"]
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version("main", branch="main")
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version("0.7.0", "5390b20102474a3c37240f38226f3a54a809b34bcb910317bdd109b8c2865f4e")
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version("0.6.0", "c057361565f570cb128489c70131487f71b6891a40e5292dfe37041596810dfe")
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version("0.5.1", "0411fdaebe438f652a970cb232ae3199c4cc840366ed05fda4c38e634632040d")
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variant("openmp", default=True, description="Use OpenMP parallelisation")
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variant("python", default=False, description="Build Python extension module")
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depends_on("mctc-lib")
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depends_on("meson@0.57.1:", type="build") # mesonbuild/meson#8377
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depends_on("pkgconfig", type="build")
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depends_on("toml-f")
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depends_on("py-cffi", when="+python")
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depends_on("python@3.6:", when="+python")
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extends("python", when="+python")
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def meson_args(self):
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return [
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"-Dopenmp={0}".format(str("+openmp" in self.spec).lower()),
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"-Dpython={0}".format(str("+python" in self.spec).lower()),
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]
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