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science/libcint: Update 4.4.6 -> 5.1.0

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Bump science/py-pyscf and add libcint compatibility patch.

Reported by:	portscout
This commit is contained in:
Yuri Victorovich 2021-12-26 12:20:27 -08:00
parent fd31c9c7ce
commit 4db755b427
4 changed files with 11 additions and 5 deletions
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2
science/libcint/Makefile
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@ -1,6 +1,6 @@
PORTNAME= libcint
DISTVERSIONPREFIX= v
DISTVERSION= 4.4.6
DISTVERSION= 5.1.0
CATEGORIES= science
MAINTAINER= yuri@FreeBSD.org

6
science/libcint/distinfo
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@ -1,3 +1,3 @@
TIMESTAMP = 1634421971
SHA256 (sunqm-libcint-v4.4.6_GH0.tar.gz) = 215e186e35f272f36e527f6da8fe3ab3f53d4ceb3afbdca75755e6ebd5b60719
SIZE (sunqm-libcint-v4.4.6_GH0.tar.gz) = 43008937
TIMESTAMP = 1640537980
SHA256 (sunqm-libcint-v5.1.0_GH0.tar.gz) = 37aaf9134e3160a7d770e703f7de54c032d55afe8abff64b9793040ae9e14272
SIZE (sunqm-libcint-v5.1.0_GH0.tar.gz) = 43004110

4
science/py-pyscf/Makefile
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@ -1,9 +1,13 @@
PORTNAME= pyscf
DISTVERSIONPREFIX= v
DISTVERSION= 2.0.1
PORTREVISION= 1
CATEGORIES= science python
PKGNAMEPREFIX= ${PYTHON_PKGNAMEPREFIX}
PATCH_SITES= https://github.com/${GH_ACCOUNT}/${GH_PROJECT}/commit/
PATCHFILES= 6fece0e44feef43dcb879f3c2e6a2d84a26d518f.patch:-p1 # https://github.com/pyscf/pyscf/pull/1145: Update to libcint v5.0
MAINTAINER= yuri@FreeBSD.org
COMMENT= Python module for quantum chemistry

4
science/py-pyscf/distinfo
View File

@ -1,3 +1,5 @@
TIMESTAMP = 1637098413
TIMESTAMP = 1640549794
SHA256 (pyscf-pyscf-v2.0.1_GH0.tar.gz) = 6a152860787351aae52dc1ef2399bd9564fa314dca070312cfc0f2c3fc7412cf
SIZE (pyscf-pyscf-v2.0.1_GH0.tar.gz) = 9641485
SHA256 (6fece0e44feef43dcb879f3c2e6a2d84a26d518f.patch) = d3195bae8a3d1bcf25fa474762a9f2dc163a936840ef1ed9406c78b04e1f6efc
SIZE (6fece0e44feef43dcb879f3c2e6a2d84a26d518f.patch) = 6038