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| author | Massimiliano Culpo <massimiliano.culpo@gmail.com> | 2022-05-12 19:47:47 +0200 |
|---|---|---|
| committer | GitHub <noreply@github.com> | 2022-05-12 19:47:47 +0200 |
| commit | 3625ea47264c72549cf18499bc95d36163d6d997 (patch) | |
| tree | b033315fa9f46a0696ed55ed268341c43e4078f0 /var | |
| parent | 245b95223d82312d5c60bd9fdc2e613c4ff621e1 (diff) | |
| download | spack-3625ea47264c72549cf18499bc95d36163d6d997.tar.gz spack-3625ea47264c72549cf18499bc95d36163d6d997.tar.bz2 spack-3625ea47264c72549cf18499bc95d36163d6d997.tar.xz spack-3625ea47264c72549cf18499bc95d36163d6d997.zip | |
Revert "atompaw: add new package (#30619)" (#30647)
This reverts commit 12b0278f08c5557c8c458fdbf4886c5f67aa40c9.
Diffstat (limited to 'var')
| -rw-r--r-- | var/spack/repos/builtin/atompaw/package.py | 41 |
1 files changed, 0 insertions, 41 deletions
diff --git a/var/spack/repos/builtin/atompaw/package.py b/var/spack/repos/builtin/atompaw/package.py deleted file mode 100644 index d6a4024fad..0000000000 --- a/var/spack/repos/builtin/atompaw/package.py +++ /dev/null @@ -1,41 +0,0 @@ -# Copyright 2013-2022 Lawrence Livermore National Security, LLC and other -# Spack Project Developers. See the top-level COPYRIGHT file for details. -# -# SPDX-License-Identifier: (Apache-2.0 OR MIT) - -from spack import * - - -class Atompaw(AutotoolsPackage): - """atompaw generates projector augmented wave (PAW) - potentials for electronics structure calculations.""" - - homepage = "https://users.wfu.edu/natalie/papers/pwpaw/" - url = "https://users.wfu.edu/natalie/papers/pwpaw/atompaw-4.2.0.0.tar.gz" - - version('4.2.0.0', sha256='9ab4f4ab78a720fbcd95bbbc1403e8ff348d15570e7c694932a56be15985e93d') - version('4.1.1.0', sha256='b1ee2b53720066655d98523ef337e54850cb1e68b3a2da04ff5a1576d3893891') - version('4.1.0.6', sha256='42a46c0569367c0b971fbc3dcaf5eaec7020bdff111022b6f320de9f11c41c2c') - - variant('libxc', default=False, description='Compile with libxc') - variant('shared', default=True) - - depends_on('libxc', when='+libxc') - depends_on('blas') - - def configure_args(self): - spec = self.spec - - args = ['--with-linalg-prefix=' + spec['blas'].prefix] - args += ['--with-linalg-libs=' + ' '.join(spec['blas'].libs)] - - if '+libxc' in spec: - args += ['--enable-libxc'] - args += ['--with-libxc-prefix=' + spec['libxc'].prefix] - - if '+shared' in spec: - args += ['--enable-shared'] - else: - args += ['--enable-static'] - - return args |