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| author | Yuri Victorovich <yuri@FreeBSD.org> | 2018-06-15 17:42:24 +0000 |
|---|---|---|
| committer | Yuri Victorovich <yuri@FreeBSD.org> | 2018-06-15 17:42:24 +0000 |
| commit | eda32fd6c33180da9f4529df63223edc82c5f375 (patch) | |
| tree | f792bd0344ddaf92895e6afb8dcc86d5b3ba4c29 /science | |
| parent | ebd7bd957bb4aad87061b8c41a1f3ddbf4f4b38f (diff) | |
| download | ports-eda32fd6c33180da9f4529df63223edc82c5f375.tar.gz ports-eda32fd6c33180da9f4529df63223edc82c5f375.zip | |
New port: science/spglib: C library for finding and handling crystal symmetries
Notes
Notes:
svn path=/head/; revision=472472
Diffstat (limited to 'science')
| -rw-r--r-- | science/Makefile | 1 | ||||
| -rw-r--r-- | science/spglib/Makefile | 21 | ||||
| -rw-r--r-- | science/spglib/distinfo | 3 | ||||
| -rw-r--r-- | science/spglib/pkg-descr | 11 | ||||
| -rw-r--r-- | science/spglib/pkg-plist | 25 |
5 files changed, 61 insertions, 0 deletions
diff --git a/science/Makefile b/science/Makefile index 7083b53ddb50..000b3baa66c6 100644 --- a/science/Makefile +++ b/science/Makefile @@ -218,6 +218,7 @@ SUBDIR += silo SUBDIR += simlib SUBDIR += simsmith + SUBDIR += spglib SUBDIR += step SUBDIR += step-kde4 SUBDIR += svmlight diff --git a/science/spglib/Makefile b/science/spglib/Makefile new file mode 100644 index 000000000000..ce13c9c8e2af --- /dev/null +++ b/science/spglib/Makefile @@ -0,0 +1,21 @@ +# $FreeBSD$ + +PORTNAME= spglib +DISTVERSIONPREFIX= v +DISTVERSION= 1.10.3 +CATEGORIES= science + +MAINTAINER= yuri@FreeBSD.org +COMMENT= C library for finding and handling crystal symmetries + +LICENSE= BSD3CLAUSE +LICENSE_FILE= ${WRKSRC}/COPYING + +USES= autoreconf libtool +USE_GITHUB= yes +GH_ACCOUNT= atztogo +GNU_CONFIGURE= yes +CONFIGURE_ARGS= --disable-static +USE_LDCONFIG= yes + +.include <bsd.port.mk> diff --git a/science/spglib/distinfo b/science/spglib/distinfo new file mode 100644 index 000000000000..4999db8fd6e3 --- /dev/null +++ b/science/spglib/distinfo @@ -0,0 +1,3 @@ +TIMESTAMP = 1529084268 +SHA256 (atztogo-spglib-v1.10.3_GH0.tar.gz) = 43776b5fb220b746d53c1aa39d0230f304687ec05984671392bccaf850d9d696 +SIZE (atztogo-spglib-v1.10.3_GH0.tar.gz) = 1949650 diff --git a/science/spglib/pkg-descr b/science/spglib/pkg-descr new file mode 100644 index 000000000000..434fa2852b04 --- /dev/null +++ b/science/spglib/pkg-descr @@ -0,0 +1,11 @@ +Spglib is a library for finding and handling crystal symmetries written in C. + +Features: +* Find symmetry operations +* Identify space-group type +* Wyckoff position assignment +* Refine crystal structure +* Find a primitive cell +* Search irreducible k-points + +WWW: https://atztogo.github.io/spglib/ diff --git a/science/spglib/pkg-plist b/science/spglib/pkg-plist new file mode 100644 index 000000000000..3167c7bf1971 --- /dev/null +++ b/science/spglib/pkg-plist @@ -0,0 +1,25 @@ +include/spglib/arithmetic.h +include/spglib/cell.h +include/spglib/debug.h +include/spglib/delaunay.h +include/spglib/determination.h +include/spglib/hall_symbol.h +include/spglib/kgrid.h +include/spglib/kpoint.h +include/spglib/mathfunc.h +include/spglib/niggli.h +include/spglib/overlap.h +include/spglib/pointgroup.h +include/spglib/primitive.h +include/spglib/refinement.h +include/spglib/site_symmetry.h +include/spglib/sitesym_database.h +include/spglib/spacegroup.h +include/spglib/spg_database.h +include/spglib/spglib.h +include/spglib/spin.h +include/spglib/symmetry.h +include/spglib/version.h +lib/libsymspg.so +lib/libsymspg.so.0 +lib/libsymspg.so.0.0.0 |