2018-09-04 17:05:19 +02:00
|
|
|
# $FreeBSD$
|
|
|
|
|
|
|
|
|
|
PORTNAME= atom
|
|
|
|
|
DISTVERSION= 4.2.7-100
|
Bump PORTREVISION for ports depending on the canonical version of GCC
defined via Mk/bsd.default-versions.mk which has moved from GCC 7.4 t
GCC 8.2 under most circumstances.
This includes ports
- with USE_GCC=yes or USE_GCC=any,
- with USES=fortran,
- using Mk/bsd.octave.mk which in turn features USES=fortran, and
- with USES=compiler specifying openmp, nestedfct, c11, c++0x, c++11-lang,
c++11-lib, c++14-lang, c++17-lang, or gcc-c++11-lib
plus, as a double check, everything INDEX-11 showed depending on lang/gcc7.
PR: 231590
2018-12-12 02:35:33 +01:00
|
|
|
PORTREVISION= 3
|
2018-09-04 17:05:19 +02:00
|
|
|
CATEGORIES= science
|
|
|
|
|
MASTER_SITES= https://departments.icmab.es/leem/siesta/Pseudopotentials/Code/ \
|
|
|
|
|
https://departments.icmab.es/leem/siesta/Pseudopotentials/:lic
|
2018-09-04 18:42:27 +02:00
|
|
|
PKGNAMESUFFIX= -chemistry
|
2018-09-04 17:05:19 +02:00
|
|
|
DISTFILES= ${DISTNAME}${EXTRACT_SUFX} atom_licence.html:lic
|
2018-09-04 18:42:27 +02:00
|
|
|
DIST_SUBDIR= ${PORTNAME}${PKGNAMESUFFIX}
|
2018-09-04 17:05:19 +02:00
|
|
|
EXTRACT_ONLY= ${DISTNAME}${EXTRACT_SUFX}
|
|
|
|
|
|
|
|
|
|
MAINTAINER= yuri@FreeBSD.org
|
|
|
|
|
COMMENT= Program for DFT calculations in atoms
|
|
|
|
|
|
|
|
|
|
LICENSE= ATOM_LICENSE
|
|
|
|
|
LICENSE_NAME= ATOM ACADEMIC LICENCE
|
2018-09-04 18:42:27 +02:00
|
|
|
LICENSE_FILE= ${DISTDIR}/${DIST_SUBDIR}/atom_licence.html
|
2018-10-21 01:29:28 +02:00
|
|
|
LICENSE_PERMS= # none
|
2018-09-04 17:05:19 +02:00
|
|
|
|
|
|
|
|
LIB_DEPENDS= libGridXC.so:science/libgridxc \
|
|
|
|
|
libxc.so:science/libxc \
|
|
|
|
|
libxmlf90.so:textproc/xmlf90
|
|
|
|
|
|
|
|
|
|
USES= fortran gmake tar:tgz
|
|
|
|
|
|
|
|
|
|
MAKE_ENV= XMLF90_ROOT=${LOCALBASE} GRIDXC_ROOT=${LOCALBASE} LIBXC_ROOT=${LOCALBASE}
|
|
|
|
|
MAKE_ARGS= FC=gfortran${GCC_DEFAULT} LDFLAGS="${LDFLAGS}"
|
|
|
|
|
ALL_TARGET= default
|
|
|
|
|
|
|
|
|
|
PLIST_FILES= bin/atm
|
|
|
|
|
|
|
|
|
|
post-patch:
|
|
|
|
|
@${CP} ${WRKSRC}/arch.make.sample ${WRKSRC}/arch.make
|
|
|
|
|
|
|
|
|
|
do-install:
|
|
|
|
|
${INSTALL_PROGRAM} ${WRKSRC}/atm ${STAGEDIR}${PREFIX}/bin/
|
|
|
|
|
|
|
|
|
|
.include <bsd.port.mk>
|
