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| author | Ye Luo <yeluo@anl.gov> | 2021-12-24 07:13:05 -0600 |
|---|---|---|
| committer | GitHub <noreply@github.com> | 2021-12-24 14:13:05 +0100 |
| commit | e945d3763bba4af884299475bae36c76d8c17bbb (patch) | |
| tree | 725ae0b2a469de6f4e2efc7250de8d4d5ce10aae | |
| parent | 262c680997daa75e0abfc68b03adbd87b30af737 (diff) | |
| download | spack-e945d3763bba4af884299475bae36c76d8c17bbb.tar.gz spack-e945d3763bba4af884299475bae36c76d8c17bbb.tar.bz2 spack-e945d3763bba4af884299475bae36c76d8c17bbb.tar.xz spack-e945d3763bba4af884299475bae36c76d8c17bbb.zip | |
quantum-espresso: add v7.0 (#28144)
| -rw-r--r-- | var/spack/repos/builtin/packages/quantum-espresso/package.py | 6 |
1 files changed, 6 insertions, 0 deletions
diff --git a/var/spack/repos/builtin/packages/quantum-espresso/package.py b/var/spack/repos/builtin/packages/quantum-espresso/package.py index f2dcd3b666..9b5f9f27aa 100644 --- a/var/spack/repos/builtin/packages/quantum-espresso/package.py +++ b/var/spack/repos/builtin/packages/quantum-espresso/package.py @@ -18,6 +18,7 @@ class QuantumEspresso(CMakePackage): maintainers = ['ye-luo'] version('develop', branch='develop') + version('7.0', sha256='85beceb1aaa1678a49e774c085866d4612d9d64108e0ac49b23152c8622880ee') version('6.8', sha256='654855c69864de7ece5ef2f2c0dea2d32698fe51192a8646b1555b0c57e033b2') version('6.7', sha256='fe0ce74ff736b10d2a20c9d59025c01f88f86b00d229c123b1791f1edd7b4315', url='https://gitlab.com/QEF/q-e/-/archive/qe-6.7MaX-Release/q-e-qe-6.7MaX-Release.tar.gz' @@ -218,6 +219,11 @@ class QuantumEspresso(CMakePackage): conflicts('@6.5:', when='+environ', msg='6.4.x is the latest QE series supported by Environ') + # 7.0 + patch_url = 'https://raw.githubusercontent.com/QMCPACK/qmcpack/develop/external_codes/quantum_espresso/add_pw2qmcpack_to_qe-7.0.diff' + patch_checksum = 'ef60641d8b953b4ba21d9c662b172611305bb63786996ad6e81e7609891677ff' + patch(patch_url, sha256=patch_checksum, when='@7.0+qmcpack') + # 6.8 patch_url = 'https://raw.githubusercontent.com/QMCPACK/qmcpack/develop/external_codes/quantum_espresso/add_pw2qmcpack_to_qe-6.8.diff' patch_checksum = '69f7fbd72aba810c35a0b034188e45bea8f9f11d3150c0715e1b3518d5c09248' |