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science/libxc: upgrade to libXC 6

Browse Source 
Changelog at <https://www.tddft.org/programs/libxc/changes/>.

PR:		267356
Approved by:	jmd (maintainer)
This commit is contained in:
Thierry Thomas 2022-10-23 19:14:04 +02:00
parent 26375b2a2d
commit 4d60af922f
4 changed files with 32 additions and 17 deletions
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15
science/libxc/Makefile
View File

@ -1,6 +1,5 @@
PORTNAME= libxc
DISTVERSION= 5.2.3
PORTREVISION= 1
DISTVERSION= 6.0.0
CATEGORIES= science
MASTER_SITES= https://www.tddft.org/programs/${PORTNAME}/down/${DISTVERSION}/
@ -8,13 +7,19 @@ MAINTAINER= jmd@FreeBSD.org
COMMENT= Library of exchange-correlation functionals for DFT
WWW= https://www.tddft.org/programs/libxc/
LICENSE= LGPL3+
LICENSE= MPL20
LICENSE_FILE= ${WRKSRC}/COPYING
USES= cmake:testing fortran
USES= cmake:testing fortran python
USE_LDCONFIG= yes
TEST_DEPENDS= bash:shells/bash
CMAKE_ON= BUILD_SHARED_LIBS ENABLE_FORTRAN
CMAKE_ON= BUILD_SHARED_LIBS ENABLE_FORTRAN ENABLE_PYTHON
CMAKE_OFF= BUILD_TESTING
pre-configure:
${REINPLACE_CMD} -e 's|$${CMAKE_INSTALL_LIBDIR}/pylibxc$$|${PYTHONPREFIX_SITELIBDIR}/pylibxc|' \
-e 's|$${CMAKE_INSTALL_PREFIX}/$${CMAKE_INSTALL_LIBDIR}/pylibxc/|${STAGEDIR}${PYTHONPREFIX_SITELIBDIR}/pylibxc/|'\
${WRKSRC}/CMakeLists.txt
.include <bsd.port.mk>

6
science/libxc/distinfo
View File

@ -1,3 +1,3 @@
TIMESTAMP = 1653368771
SHA256 (libxc-5.2.3.tar.gz) = 7b7a96d8eeb472c7b8cca7ac38eae27e0a8113ef44dae5359b0eb12592b4bcf2
SIZE (libxc-5.2.3.tar.gz) = 45810705
TIMESTAMP = 1666539454
SHA256 (libxc-6.0.0.tar.gz) = c2ca205a762200dfba2e6c9e8ca2061aaddc6b7cf42048859fe717a7aa07de7c
SIZE (libxc-6.0.0.tar.gz) = 62940412

2
science/libxc/pkg-descr
View File

@ -5,3 +5,5 @@ and also other codes.
In libxc you can find different types of functionals: LDA, GGA, hybrids,
and mGGA (experimental).
See also: <https://gitlab.com/libxc/libxc>.

26
science/libxc/pkg-plist
View File

@ -6,18 +6,26 @@ include/xc_funcs.h
include/xc_funcs_removed.h
include/xc_funcs_worker.h
include/xc_version.h
lib/cmake/Libxc/LibxcConfig.cmake
lib/cmake/Libxc/LibxcConfigVersion.cmake
lib/cmake/Libxc/LibxcTargets-C-%%CMAKE_BUILD_TYPE%%.cmake
lib/cmake/Libxc/LibxcTargets-C.cmake
lib/cmake/Libxc/LibxcTargets-Fortran-%%CMAKE_BUILD_TYPE%%.cmake
lib/cmake/Libxc/LibxcTargets-Fortran.cmake
lib/libxc.so
lib/libxc.so.9
lib/libxc.so.12
lib/libxcf03.so
lib/libxcf03.so.9
lib/libxcf03.so.12
lib/libxcf90.so
lib/libxcf90.so.9
lib/libxcf90.so.12
%%PYTHON_SITELIBDIR%%/pylibxc/__init__.py
%%PYTHON_SITELIBDIR%%/pylibxc/core.py
%%PYTHON_SITELIBDIR%%/pylibxc/flags.py
%%PYTHON_SITELIBDIR%%/pylibxc/functional.py
%%PYTHON_SITELIBDIR%%/pylibxc/libxc.so
%%PYTHON_SITELIBDIR%%/pylibxc/structs.py
%%PYTHON_SITELIBDIR%%/pylibxc/util.py
%%PYTHON_SITELIBDIR%%/pylibxc/version.py
libdata/pkgconfig/libxc.pc
libdata/pkgconfig/libxcf03.pc
libdata/pkgconfig/libxcf90.pc
share/cmake/Libxc/LibxcConfig.cmake
share/cmake/Libxc/LibxcConfigVersion.cmake
share/cmake/Libxc/LibxcTargets-C-%%CMAKE_BUILD_TYPE%%.cmake
share/cmake/Libxc/LibxcTargets-C.cmake
share/cmake/Libxc/LibxcTargets-Fortran-%%CMAKE_BUILD_TYPE%%.cmake
share/cmake/Libxc/LibxcTargets-Fortran.cmake