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science/dftbplus: Change to python3.

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This commit is contained in:
Yuri Victorovich 2020-05-20 00:36:40 +00:00
parent 7d9d936f2c
commit b0c0e1764b
Notes: svn2git 2021-03-31 03:12:20 +00:00 
svn path=/head/; revision=535961
2 changed files with 30 additions and 29 deletions
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7
science/dftbplus/Makefile
View file

@ -2,6 +2,7 @@
PORTNAME= dftbplus
DISTVERSION= 19.1
PORTREVISION= 1
CATEGORIES= science
MAINTAINER= yuri@FreeBSD.org
@ -9,15 +10,13 @@ COMMENT= DFTB+: Package for performing fast atomistic simulations
LICENSE= GPLv3 # main code is under LGPL3+, the bundled dftd3-lib is under GPLv1+, this makes the result GPLv3 (based on https://www.gnu.org/licenses/gpl-faq.html#AllCompatibility)
DEPRECATED= Uses deprecated version of python
EXPIRATION_DATE= 2020-08-15
BROKEN_powerpc64= fails to compile: lbfgs.f90:18:19: Cannot find an intrinsic module named 'ieee_arithmetic' at (1)
LIB_DEPENDS= libblas.so:math/blas \
liblapack.so:math/lapack
RUN_DEPENDS= ${PYNUMPY}
USES= compiler:gcc-c++11-lib fortran gmake python:2.7 shebangfix
USES= compiler:gcc-c++11-lib fortran gmake python shebangfix
SHEBANG_FILES= tools/dptools/bin/* tools/misc/* utils/srcmanip/* utils/build/* external/fypp/bin/* utils/get_opt_externals \
external/fypp/bin/fypp utils/test/testlist_to_fypp test/prog/dftb+/bin/tagdiff
SHEBANG_GLOB= *.py
@ -35,6 +34,8 @@ LDFLAGS+= -llapack -lblas -lgfortran -lm
MAKE_ARGS= PYTHON=${PYTHON_CMD} FC=${FC} FXX=${FC} LN=${CC} \
INSTALLDIR=${STAGEDIR}${PREFIX} FREEBSD_PYDISTUTILS_INSTALLARGS="${PYDISTUTILS_INSTALLARGS} --root=${STAGEDIR}"
BINARY_ALIAS= python=${PYTHON_CMD}
OPTIONS_DEFINE= DFTD3 MPI SOCKETS ARPACK
OPTIONS_DEFAULT= DFTD3 MPI SOCKETS

52
science/dftbplus/pkg-plist
View file

@ -11,41 +11,41 @@ bin/waveplot
bin/xyz2gen
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