svn commit: r490535 - head/science/erkale
Yuri Victorovich
yuri at FreeBSD.org
Thu Jan 17 09:40:26 UTC 2019
Author: yuri
Date: Thu Jan 17 09:40:24 2019
New Revision: 490535
URL: https://svnweb.freebsd.org/changeset/ports/490535
Log:
science/erkale: Update 0927d8c -> 0c285c1
Port changes:
* Add the standard location for erkale's pseudopotentials.
* Add pkg-message suggesting to install erkale-pseudopotentials
Added:
head/science/erkale/pkg-message (contents, props changed)
Modified:
head/science/erkale/Makefile
head/science/erkale/distinfo
Modified: head/science/erkale/Makefile
==============================================================================
--- head/science/erkale/Makefile Thu Jan 17 09:33:46 2019 (r490534)
+++ head/science/erkale/Makefile Thu Jan 17 09:40:24 2019 (r490535)
@@ -1,8 +1,7 @@
# $FreeBSD$
PORTNAME= erkale
-DISTVERSION= g20181121
-PORTREVISION= 4
+DISTVERSION= g20190114
CATEGORIES= science
MAINTAINER= yuri at FreeBSD.org
@@ -29,12 +28,13 @@ serial_PKGNAMESUFFIX= -serial
USES= cmake:noninja fortran pkgconfig
USE_GITHUB= yes
GH_ACCOUNT= susilehtola
-GH_TAGNAME= 0927d8c
+GH_TAGNAME= 0c285c1
USE_LDCONFIG= yes
TEST_TARGET= test
CMAKE_ON= BUILD_SHARED_LIBS
+CMAKE_ARGS= -DERKALE_SYSTEM_LIBRARY=${DATADIR}/basis
PLIST_SUB= SUFFIX="${SUFFIX}"
@@ -58,7 +58,7 @@ NETLIB_LIB_DEPENDS= libcblas.so:math/cblas
OPENBLAS_USES= blaslapack:openblas
OPENBLAS_CMAKE_ON= -DLAPACK_LIBRARIES:STRING=-lopenblas -DBLAS_LIBRARIES:STRING=-lopenblasp
-xOPENBLAS_BROKEN= hits the number of threads limit: https://github.com/xianyi/OpenBLAS/issues/1882
+OPENBLAS_BROKEN= hits the number of threads limit: https://github.com/xianyi/OpenBLAS/issues/1882
# use clang from ports because cmake can't find OpenMP with base clang, see https://bugs.freebsd.org/bugzilla/show_bug.cgi?id=223678
# have the same compiler for both serial and parallel flavors so that performance numbers can be compared
Modified: head/science/erkale/distinfo
==============================================================================
--- head/science/erkale/distinfo Thu Jan 17 09:33:46 2019 (r490534)
+++ head/science/erkale/distinfo Thu Jan 17 09:40:24 2019 (r490535)
@@ -1,3 +1,3 @@
-TIMESTAMP = 1542835027
-SHA256 (susilehtola-erkale-g20181121-0927d8c_GH0.tar.gz) = d5b76b05e8b3cbb2abe688e5f493abc61102cc41daa5d6ac65563384b6c4c6c0
-SIZE (susilehtola-erkale-g20181121-0927d8c_GH0.tar.gz) = 109987868
+TIMESTAMP = 1547713662
+SHA256 (susilehtola-erkale-g20190114-0c285c1_GH0.tar.gz) = ac8703a7f56caf06a887dfb082b7dda896637f52279305e0ea3a606733af74f3
+SIZE (susilehtola-erkale-g20190114-0c285c1_GH0.tar.gz) = 111334148
Added: head/science/erkale/pkg-message
==============================================================================
--- /dev/null 00:00:00 1970 (empty, because file is newly added)
+++ head/science/erkale/pkg-message Thu Jan 17 09:40:24 2019 (r490535)
@@ -0,0 +1,7 @@
+======================================================================
+You installed Erkale: a quantum chemistry program used to solve the
+electronic structure of atoms.
+
+Most likely you also need to install erkale-pseudopotentials, a set of
+pseudopotential files needed for almost every Erkale operation.
+======================================================================
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