Skip site navigation (1)Skip section navigation (2)
Date:      Thu, 17 Jan 2019 09:40:24 +0000 (UTC)
From:      Yuri Victorovich <yuri@FreeBSD.org>
To:        ports-committers@freebsd.org, svn-ports-all@freebsd.org, svn-ports-head@freebsd.org
Subject:   svn commit: r490535 - head/science/erkale
Message-ID:  <201901170940.x0H9eOsr097290@repo.freebsd.org>

next in thread | raw e-mail | index | archive | help
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@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.
+======================================================================



Want to link to this message? Use this URL: <https://mail-archive.FreeBSD.org/cgi/mid.cgi?201901170940.x0H9eOsr097290>