Date: Thu, 17 Jan 2019 09:42:54 +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: r490536 - in head/science: . erkale-pseudopotentials Message-ID: <201901170942.x0H9gsQR002389@repo.freebsd.org>
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Author: yuri Date: Thu Jan 17 09:42:53 2019 New Revision: 490536 URL: https://svnweb.freebsd.org/changeset/ports/490536 Log: New port: science/erkale-pseudopotentials: Pseudopotentials for Erkale, the quantum chemistry program Added: head/science/erkale-pseudopotentials/ head/science/erkale-pseudopotentials/Makefile (contents, props changed) head/science/erkale-pseudopotentials/distinfo (contents, props changed) head/science/erkale-pseudopotentials/pkg-descr (contents, props changed) head/science/erkale-pseudopotentials/pkg-plist (contents, props changed) Modified: head/science/Makefile Modified: head/science/Makefile ============================================================================== --- head/science/Makefile Thu Jan 17 09:40:24 2019 (r490535) +++ head/science/Makefile Thu Jan 17 09:42:53 2019 (r490536) @@ -72,6 +72,7 @@ SUBDIR += epte SUBDIR += erd SUBDIR += erkale + SUBDIR += erkale-pseudopotentials SUBDIR += esys-particle SUBDIR += fastcap SUBDIR += fasthenry Added: head/science/erkale-pseudopotentials/Makefile ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/erkale-pseudopotentials/Makefile Thu Jan 17 09:42:53 2019 (r490536) @@ -0,0 +1,26 @@ +# $FreeBSD$ + +PORTNAME= erkale-pseudopotentials +DISTVERSION= g20190114 +CATEGORIES= science + +MAINTAINER= yuri@FreeBSD.org +COMMENT= Pseudopotentials for Erkale, the quantum chemistry program + +LICENSE= GPLv2 +LICENSE_FILE= ${WRKSRC}/COPYING + +USE_GITHUB= yes +GH_ACCOUNT= susilehtola +GH_PROJECT= erkale +GH_TAGNAME= 0c285c1 + +NO_BUILD= yes +NO_ARCH= yes + +DATADIR= ${LOCALBASE}/share/erkale + +do-install: + @cd ${WRKSRC} && ${COPYTREE_SHARE} basis ${STAGEDIR}${DATADIR} + +.include <bsd.port.mk> Added: head/science/erkale-pseudopotentials/distinfo ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/erkale-pseudopotentials/distinfo Thu Jan 17 09:42:53 2019 (r490536) @@ -0,0 +1,3 @@ +TIMESTAMP = 1547713662 +SHA256 (susilehtola-erkale-g20190114-0c285c1_GH0.tar.gz) = ac8703a7f56caf06a887dfb082b7dda896637f52279305e0ea3a606733af74f3 +SIZE (susilehtola-erkale-g20190114-0c285c1_GH0.tar.gz) = 111334148 Added: head/science/erkale-pseudopotentials/pkg-descr ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/erkale-pseudopotentials/pkg-descr Thu Jan 17 09:42:53 2019 (r490536) @@ -0,0 +1,4 @@ +Pseudopotentials for ERKALE, a quantum chemistry program used to solve the +electronic structure of atoms, molecules and molecular clusters. + +WWW: https://github.com/susilehtola/erkale Added: head/science/erkale-pseudopotentials/pkg-plist ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/erkale-pseudopotentials/pkg-plist Thu Jan 17 09:42:53 2019 (r490536) @@ -0,0 +1,282 @@ +%%DATADIR%%/basis/3-21++G.gbs +%%DATADIR%%/basis/3-21+G.gbs +%%DATADIR%%/basis/3-21G.gbs +%%DATADIR%%/basis/4-31G.gbs +%%DATADIR%%/basis/5ZP-DKH.gbs +%%DATADIR%%/basis/5ZP.gbs +%%DATADIR%%/basis/6-21G.gbs +%%DATADIR%%/basis/6-31++G(2d,2p).gbs +%%DATADIR%%/basis/6-31++G(2df,2pd).gbs +%%DATADIR%%/basis/6-31++G(3d,3p).gbs +%%DATADIR%%/basis/6-31++G(3df,3pd).gbs +%%DATADIR%%/basis/6-31++G(d,p).gbs +%%DATADIR%%/basis/6-31++G(df,pd).gbs +%%DATADIR%%/basis/6-31++G.gbs +%%DATADIR%%/basis/6-31+G(2d,2p).gbs +%%DATADIR%%/basis/6-31+G(2df,2pd).gbs +%%DATADIR%%/basis/6-31+G(3d,3p).gbs +%%DATADIR%%/basis/6-31+G(3df,3pd).gbs +%%DATADIR%%/basis/6-31+G(d,p).gbs +%%DATADIR%%/basis/6-31+G(df,pd).gbs +%%DATADIR%%/basis/6-31+G.gbs +%%DATADIR%%/basis/6-311++G(2d,2p).gbs +%%DATADIR%%/basis/6-311++G(2df,2pd).gbs +%%DATADIR%%/basis/6-311++G(3d,3p).gbs +%%DATADIR%%/basis/6-311++G(3df,3pd).gbs +%%DATADIR%%/basis/6-311++G(d,p).gbs +%%DATADIR%%/basis/6-311++G(df,pd).gbs +%%DATADIR%%/basis/6-311++G.gbs +%%DATADIR%%/basis/6-311+G(2d,2p).gbs +%%DATADIR%%/basis/6-311+G(2df,2pd).gbs +%%DATADIR%%/basis/6-311+G(3d,3p).gbs +%%DATADIR%%/basis/6-311+G(3df,3pd).gbs +%%DATADIR%%/basis/6-311+G(d,p).gbs +%%DATADIR%%/basis/6-311+G(df,pd).gbs +%%DATADIR%%/basis/6-311+G.gbs +%%DATADIR%%/basis/6-311G(2d,2p).gbs +%%DATADIR%%/basis/6-311G(2df,2pd).gbs +%%DATADIR%%/basis/6-311G(3d,3p).gbs +%%DATADIR%%/basis/6-311G(3df,3pd).gbs +%%DATADIR%%/basis/6-311G(d,p).gbs +%%DATADIR%%/basis/6-311G(df,pd).gbs +%%DATADIR%%/basis/6-311G.gbs +%%DATADIR%%/basis/6-31G(2d,2p).gbs +%%DATADIR%%/basis/6-31G(2df,2pd).gbs +%%DATADIR%%/basis/6-31G(3d,3p).gbs +%%DATADIR%%/basis/6-31G(3df,3pd).gbs +%%DATADIR%%/basis/6-31G(d,p).gbs +%%DATADIR%%/basis/6-31G(df,pd).gbs +%%DATADIR%%/basis/6-31G.gbs +%%DATADIR%%/basis/6ZP-DKH.gbs +%%DATADIR%%/basis/6ZP.gbs +%%DATADIR%%/basis/A5ZP.gbs +%%DATADIR%%/basis/ADZP.gbs 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