62927654dd
We'd like to use a consistent checksum scheme everywhere so that we can:
a) incorporate archive checksums into our specs and have a
consistent hashing algorithm across all specs.
b) index mirrors with a consistent type of checksum, and not one that
is dependent on how spack packages are written.
- [x] convert existing md5, sha224, sha512, sha1 checksums to sha256
49 lines
1.7 KiB
Python
49 lines
1.7 KiB
Python
# Copyright 2013-2019 Lawrence Livermore National Security, LLC and other
|
|
# Spack Project Developers. See the top-level COPYRIGHT file for details.
|
|
#
|
|
# SPDX-License-Identifier: (Apache-2.0 OR MIT)
|
|
|
|
|
|
from spack import *
|
|
|
|
|
|
class EtsfIo(Package):
|
|
"""ETSF_IO is a library implementing the Nanoquanta/ETSF file
|
|
format specifications.
|
|
|
|
ETSF_IO enables an architecture-independent exchange of crystallographic
|
|
data, electronic wavefunctions, densities and potentials, as well as
|
|
spectroscopic data. It is meant to be used by quantum-physical and
|
|
quantum-chemical applications relying upon Density Functional Theory (DFT).
|
|
"""
|
|
|
|
homepage = "http://www.etsf.eu/resources/software/libraries_and_tools"
|
|
url = "https://launchpad.net/etsf-io/1.0/1.0.4/+download/etsf_io-1.0.4.tar.gz"
|
|
|
|
version('1.0.4', sha256='3140c2cde17f578a0e6b63acb27a5f6e9352257a1371a17b9c15c3d0ef078fa4')
|
|
|
|
depends_on("netcdf-fortran")
|
|
depends_on("hdf5+mpi~cxx", when='+mpi') # required for NetCDF-4 support
|
|
|
|
def install(self, spec, prefix):
|
|
options = ['--prefix=%s' % prefix]
|
|
oapp = options.append
|
|
|
|
# Specify installation directory for Fortran module files
|
|
# Default is [INCLUDEDIR/FC_TYPE]
|
|
oapp("--with-moduledir=%s" % prefix.include)
|
|
|
|
# Netcdf4/HDF
|
|
hdf_libs = "-L%s -lhdf5_hl -lhdf5" % spec["hdf5"].prefix.lib
|
|
options.extend([
|
|
"--with-netcdf-incs=-I%s" % spec["netcdf-fortran"].prefix.include,
|
|
"--with-netcdf-libs=-L%s -lnetcdff -lnetcdf %s" % (
|
|
spec["netcdf-fortran"].prefix.lib, hdf_libs),
|
|
])
|
|
|
|
configure(*options)
|
|
|
|
make()
|
|
make("check")
|
|
make("install")
|