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authorYuri Victorovich <yuri@FreeBSD.org>2022-02-25 18:18:54 +0000
committerYuri Victorovich <yuri@FreeBSD.org>2022-02-25 18:19:33 +0000
commitfd4453f461eb13400066b4b74fbd2bbe840193ae (patch)
tree4fff1a7ceef250fd78b210c7eb618e9145683b5e /science
parent337a99bc8b23f5353faab2009533cae0af699789 (diff)
downloadports-fd4453f461eb13400066b4b74fbd2bbe840193ae.tar.gz
ports-fd4453f461eb13400066b4b74fbd2bbe840193ae.zip
science/nwchem: Update 7.0.2.20211110 -> 7.0.2.20220224
Diffstat (limited to 'science')
-rw-r--r--science/nwchem/Makefile6
-rw-r--r--science/nwchem/distinfo14
2 files changed, 10 insertions, 10 deletions
diff --git a/science/nwchem/Makefile b/science/nwchem/Makefile
index 9fe8a9e0d8c9..b853680f871e 100644
--- a/science/nwchem/Makefile
+++ b/science/nwchem/Makefile
@@ -1,6 +1,6 @@
PORTNAME= nwchem
DISTVERSIONPREFIX= v
-DISTVERSION= 7.0.2.20211110
+DISTVERSION= 7.0.2.20220224
DISTVERSIONSUFFIX= -release
MASTER_SITES= https://www.chemie.uni-bonn.de/pctc/mulliken-center/software/dft-d3/:dftd3 \
https://web.archive.org/web/20210527062154if_/https://www.chemie.uni-bonn.de/pctc/mulliken-center/software/dft-d3/:dft3 \
@@ -32,7 +32,7 @@ USE_PERL5= build
USE_GITHUB= yes
GH_ACCOUNT= nwchemgit
-GH_TAGNAME= 7b21660b82ebd85ef659f6fba7e1e73433b0bd0a
+GH_TAGNAME= 7a73690b20764d26dc9fdfae9ff0c110253fbf6f
MAKEFILE= GNUmakefile
ARCH_64BIT= ${ARCH:C/.*64.*/64/:S/${ARCH}//}
@@ -48,7 +48,7 @@ BINARY_ALIAS+= make=${GMAKE} # only for LIBXC
PLIST_FILES= bin/nwchem etc/nwchemrc
-LIBXC_VERSION= 5.1.7 # from src/libext/libxc/build_libxc.sh
+LIBXC_VERSION= 5.2.0 # from src/libext/libxc/build_libxc.sh
OPTIONS_DEFINE= LIBXC PYTHON
OPTIONS_DEFAULT= LIBXC PYTHON MPICH # the default should be the same as for the MPI option in math/scalapack and devel/ga
diff --git a/science/nwchem/distinfo b/science/nwchem/distinfo
index 14802ae65193..599c84825de3 100644
--- a/science/nwchem/distinfo
+++ b/science/nwchem/distinfo
@@ -1,7 +1,7 @@
-TIMESTAMP = 1636652585
-SHA256 (nwchem-7.0.2.20211110/dftd3.tgz) = d97cf9758f61aa81fd85425448fbf4a6e8ce07c12e9236739831a3af32880f59
-SIZE (nwchem-7.0.2.20211110/dftd3.tgz) = 555804
-SHA256 (nwchem-7.0.2.20211110/libxc-5.1.7.tar.gz) = 2d82b7bcfd8749490f6bb0906acf99fbf03050696dd2213da4b7a7600fc14328
-SIZE (nwchem-7.0.2.20211110/libxc-5.1.7.tar.gz) = 46172191
-SHA256 (nwchem-7.0.2.20211110/nwchemgit-nwchem-v7.0.2.20211110-release-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a_GH0.tar.gz) = d97ceb465553dc059cfa2cf003082783070aaa3b68e298dfd259205eeea98038
-SIZE (nwchem-7.0.2.20211110/nwchemgit-nwchem-v7.0.2.20211110-release-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a_GH0.tar.gz) = 198914856
+TIMESTAMP = 1645806874
+SHA256 (nwchem-7.0.2.20220224/dftd3.tgz) = d97cf9758f61aa81fd85425448fbf4a6e8ce07c12e9236739831a3af32880f59
+SIZE (nwchem-7.0.2.20220224/dftd3.tgz) = 555804
+SHA256 (nwchem-7.0.2.20220224/libxc-5.2.0.tar.gz) = 30e073ab06638c1e41a3207ec755dee6f516bdcf87988ab89bacafd6b5d3c7a5
+SIZE (nwchem-7.0.2.20220224/libxc-5.2.0.tar.gz) = 46419844
+SHA256 (nwchem-7.0.2.20220224/nwchemgit-nwchem-v7.0.2.20220224-release-7a73690b20764d26dc9fdfae9ff0c110253fbf6f_GH0.tar.gz) = 1abcb6a36e68b84dba7eedd0b12b38c65d86acbfdfa9fca7be17fd28cba3d2e6
+SIZE (nwchem-7.0.2.20220224/nwchemgit-nwchem-v7.0.2.20220224-release-7a73690b20764d26dc9fdfae9ff0c110253fbf6f_GH0.tar.gz) = 213619006