From owner-svn-ports-head@freebsd.org Sat May 18 05:40:33 2019 Return-Path: Delivered-To: svn-ports-head@mailman.ysv.freebsd.org Received: from mx1.freebsd.org (mx1.freebsd.org [IPv6:2610:1c1:1:606c::19:1]) by mailman.ysv.freebsd.org (Postfix) with ESMTP id 9077915A8FF2; Sat, 18 May 2019 05:40:33 +0000 (UTC) (envelope-from yuri@FreeBSD.org) Received: from mxrelay.nyi.freebsd.org (mxrelay.nyi.freebsd.org [IPv6:2610:1c1:1:606c::19:3]) (using TLSv1.3 with cipher TLS_AES_256_GCM_SHA384 (256/256 bits) server-signature RSA-PSS (4096 bits) client-signature RSA-PSS (4096 bits) client-digest SHA256) (Client CN "mxrelay.nyi.freebsd.org", Issuer "Let's Encrypt Authority X3" (verified OK)) by mx1.freebsd.org (Postfix) with ESMTPS id 32E546A59A; Sat, 18 May 2019 05:40:33 +0000 (UTC) (envelope-from yuri@FreeBSD.org) Received: from repo.freebsd.org (repo.freebsd.org [IPv6:2610:1c1:1:6068::e6a:0]) (using TLSv1.2 with cipher ECDHE-RSA-AES256-GCM-SHA384 (256/256 bits)) (Client did not present a certificate) by mxrelay.nyi.freebsd.org (Postfix) with ESMTPS id 0DA791B467; Sat, 18 May 2019 05:40:33 +0000 (UTC) (envelope-from yuri@FreeBSD.org) Received: from repo.freebsd.org ([127.0.1.37]) by repo.freebsd.org (8.15.2/8.15.2) with ESMTP id x4I5eWej054396; Sat, 18 May 2019 05:40:32 GMT (envelope-from yuri@FreeBSD.org) Received: (from yuri@localhost) by repo.freebsd.org (8.15.2/8.15.2/Submit) id x4I5eWLw054392; Sat, 18 May 2019 05:40:32 GMT (envelope-from yuri@FreeBSD.org) Message-Id: <201905180540.x4I5eWLw054392@repo.freebsd.org> X-Authentication-Warning: repo.freebsd.org: yuri set sender to yuri@FreeBSD.org using -f From: Yuri Victorovich Date: Sat, 18 May 2019 05:40:32 +0000 (UTC) To: ports-committers@freebsd.org, svn-ports-all@freebsd.org, svn-ports-head@freebsd.org Subject: svn commit: r501901 - in head/science: . libvdwxc X-SVN-Group: ports-head X-SVN-Commit-Author: yuri X-SVN-Commit-Paths: in head/science: . libvdwxc X-SVN-Commit-Revision: 501901 X-SVN-Commit-Repository: ports MIME-Version: 1.0 Content-Type: text/plain; charset=UTF-8 Content-Transfer-Encoding: 8bit X-Rspamd-Queue-Id: 32E546A59A X-Spamd-Bar: -- Authentication-Results: mx1.freebsd.org X-Spamd-Result: default: False [-2.98 / 15.00]; local_wl_from(0.00)[FreeBSD.org]; NEURAL_HAM_MEDIUM(-1.00)[-0.999,0]; NEURAL_HAM_SHORT(-0.98)[-0.979,0]; NEURAL_HAM_LONG(-1.00)[-1.000,0]; ASN(0.00)[asn:11403, ipnet:2610:1c1:1::/48, country:US] X-BeenThere: svn-ports-head@freebsd.org X-Mailman-Version: 2.1.29 Precedence: list List-Id: SVN commit messages for the ports tree for head List-Unsubscribe: , List-Archive: List-Post: List-Help: List-Subscribe: , X-List-Received-Date: Sat, 18 May 2019 05:40:33 -0000 Author: yuri Date: Sat May 18 05:40:31 2019 New Revision: 501901 URL: https://svnweb.freebsd.org/changeset/ports/501901 Log: New port: science/libvdwxc: Van der Waals density functional (DFT) library Added: head/science/libvdwxc/ head/science/libvdwxc/Makefile (contents, props changed) head/science/libvdwxc/distinfo (contents, props changed) head/science/libvdwxc/pkg-descr (contents, props changed) head/science/libvdwxc/pkg-plist (contents, props changed) Modified: head/science/Makefile Modified: head/science/Makefile ============================================================================== --- head/science/Makefile Sat May 18 05:30:38 2019 (r501900) +++ head/science/Makefile Sat May 18 05:40:31 2019 (r501901) @@ -132,6 +132,7 @@ SUBDIR += libssm SUBDIR += libsvm SUBDIR += libsvm-python + SUBDIR += libvdwxc SUBDIR += libxc SUBDIR += liggghts SUBDIR += lm Added: head/science/libvdwxc/Makefile ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/libvdwxc/Makefile Sat May 18 05:40:31 2019 (r501901) @@ -0,0 +1,25 @@ +# $FreeBSD$ + +PORTNAME= libvdwxc +DISTVERSION= 0.4.6.20190510 +CATEGORIES= science + +MAINTAINER= yuri@FreeBSD.org +COMMENT= Van der Waals density functional (DFT) library + +LICENSE= BSD3CLAUSE +LICENSE_FILE= ${WRKSRC}/LICENSE + +LIB_DEPENDS= libfftw3.so:math/fftw3 + +USES= autoreconf gmake libtool localbase +GNU_CONFIGURE= yes +USE_GITLAB= yes +GL_COMMIT= b1e0dd854310410012d05daf4c6661b49f31b2ab +CONFIGURE_ARGS= --disable-static +USE_LDCONFIG= yes + +post-stage: + @cd ${STAGEDIR}${PREFIX} && ${STRIP_CMD} lib/libvdwxc.so.0.0.0 lib/libvdwxcfort.so.0.0.0 + +.include Added: head/science/libvdwxc/distinfo ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/libvdwxc/distinfo Sat May 18 05:40:31 2019 (r501901) @@ -0,0 +1,3 @@ +TIMESTAMP = 1558157006 +SHA256 (libvdwxc-libvdwxc-b1e0dd854310410012d05daf4c6661b49f31b2ab_GL0.tar.gz) = 4d52f51b6fa3ea643a5c24a06038eba71d9ff0f30f87649e7753351673ea1e48 +SIZE (libvdwxc-libvdwxc-b1e0dd854310410012d05daf4c6661b49f31b2ab_GL0.tar.gz) = 7197581 Added: head/science/libvdwxc/pkg-descr ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/libvdwxc/pkg-descr Sat May 18 05:40:31 2019 (r501901) @@ -0,0 +1,7 @@ +libvdwxc is a library of density functionals, which can be linked by density +functional theory (DFT) codes, to enable the calculation of exchange and +correlation energies for van der Waals density functionals (vdW-DF). libvdwxc +evaluates correlation energy and potential using a convolution in Fourier space +using the method by Roman-Perez and Soler. + +WWW: https://libvdwxc.org/ Added: head/science/libvdwxc/pkg-plist ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/libvdwxc/pkg-plist Sat May 18 05:40:31 2019 (r501901) @@ -0,0 +1,15 @@ +bin/libvdwxc_fdtest +bin/libvdwxc_info +bin/libvdwxc_maintest +bin/libvdwxc_q0test +bin/libvdwxc_q0test2 +include/vdwxc.h +include/vdwxc_mpi.h +include/vdwxcfort.f90 +lib/libvdwxc.so +lib/libvdwxc.so.0 +lib/libvdwxc.so.0.0.0 +lib/libvdwxcfort.so +lib/libvdwxcfort.so.0 +lib/libvdwxcfort.so.0.0.0 +libdata/pkgconfig/libvdwxc.pc