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| author | Yuri Victorovich <yuri@FreeBSD.org> | 2018-09-02 21:10:29 +0000 |
|---|---|---|
| committer | Yuri Victorovich <yuri@FreeBSD.org> | 2018-09-02 21:10:29 +0000 |
| commit | 707db3a7fde24773922b990d251adb577f249033 (patch) | |
| tree | 04d4c25e7ab36b672988df3631bdb6c45720f2e4 /science/fleur | |
| parent | ff3c4f36c1df639a78a5faee8e0bedc817f52f7f (diff) | |
| download | ports-707db3a7fde24773922b990d251adb577f249033.tar.gz ports-707db3a7fde24773922b990d251adb577f249033.zip | |
New port: science/fleur: FLAPW code for atomic computations in quantum chemistry and physics
Notes
Notes:
svn path=/head/; revision=478820
Diffstat (limited to 'science/fleur')
| -rw-r--r-- | science/fleur/Makefile | 25 | ||||
| -rw-r--r-- | science/fleur/distinfo | 3 | ||||
| -rw-r--r-- | science/fleur/pkg-descr | 7 |
3 files changed, 35 insertions, 0 deletions
diff --git a/science/fleur/Makefile b/science/fleur/Makefile new file mode 100644 index 000000000000..42d1c8bd2532 --- /dev/null +++ b/science/fleur/Makefile @@ -0,0 +1,25 @@ +# $FreeBSD$ + +PORTNAME= fleur +DISTVERSION= 0.27-3 # Release 3 of Version 0.27 +CATEGORIES= science +MASTER_SITES= http://www.flapw.de/pm/uploads/FLEUR/ +DISTNAME= fleurMaXR${DISTVERSION:C/.*-//} + +MAINTAINER= yuri@FreeBSD.org +COMMENT= FLAPW code for atomic computations in quantum chemistry and physics + +LICENSE= MIT +LICENSE_FILE= ${WRKSRC}/LICENSE + +LIB_DEPENDS= libopenblas.so:math/openblas + +USES= cmake:outsource,noninja fortran localbase:ldflags tar:tgz +USE_GNOME= libxml2 + +WRKSRC= ${WRKDIR}/${PORTNAME} + +PLIST_FILES= bin/fleur \ + bin/inpgen + +.include <bsd.port.mk> diff --git a/science/fleur/distinfo b/science/fleur/distinfo new file mode 100644 index 000000000000..52a5a93da79f --- /dev/null +++ b/science/fleur/distinfo @@ -0,0 +1,3 @@ +TIMESTAMP = 1535917154 +SHA256 (fleurMaXR3.tgz) = 71dd93165ab9148cdab507084297becb6ad419e4c10be871c647e6e45caa185c +SIZE (fleurMaXR3.tgz) = 10118106 diff --git a/science/fleur/pkg-descr b/science/fleur/pkg-descr new file mode 100644 index 000000000000..0717b276e387 --- /dev/null +++ b/science/fleur/pkg-descr @@ -0,0 +1,7 @@ +The FLAPW-Method (Full Potential Linearized Augmented Plane Wave Method) is an +all-electron method which within density functional theory is universally +applicable to all atoms of the periodic table and to systems with compact +as well as open structures. It is widely considered to be the most precise +electronic structure method in solid state physics. + +WWW: http://www.flapw.de/pm/index.php |