6a26322eb3
Most of these are perl packages that need to point to the meta docs site, and then a fair amount of http addresses that need to be https, and then the rest are usually documentation sites that no longer exist or were otherwise changes Signed-off-by: vsoch <vsoch@users.noreply.github.com> Co-authored-by: vsoch <vsoch@users.noreply.github.com>
49 lines
1.7 KiB
Python
49 lines
1.7 KiB
Python
# Copyright 2013-2021 Lawrence Livermore National Security, LLC and other
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# Spack Project Developers. See the top-level COPYRIGHT file for details.
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#
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# SPDX-License-Identifier: (Apache-2.0 OR MIT)
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from spack import *
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class EtsfIo(Package):
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"""ETSF_IO is a library implementing the Nanoquanta/ETSF file
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format specifications.
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ETSF_IO enables an architecture-independent exchange of crystallographic
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data, electronic wavefunctions, densities and potentials, as well as
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spectroscopic data. It is meant to be used by quantum-physical and
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quantum-chemical applications relying upon Density Functional Theory (DFT).
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"""
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homepage = "https://github.com/ElectronicStructureLibrary/libetsf_io"
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url = "https://launchpad.net/etsf-io/1.0/1.0.4/+download/etsf_io-1.0.4.tar.gz"
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version('1.0.4', sha256='3140c2cde17f578a0e6b63acb27a5f6e9352257a1371a17b9c15c3d0ef078fa4')
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variant('mpi', default=True, description='Add MPI support')
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depends_on("netcdf-fortran")
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depends_on("hdf5+mpi~cxx", when='+mpi') # required for NetCDF-4 support
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def install(self, spec, prefix):
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options = ['--prefix=%s' % prefix]
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oapp = options.append
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# Specify installation directory for Fortran module files
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# Default is [INCLUDEDIR/FC_TYPE]
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oapp("--with-moduledir=%s" % prefix.include)
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# Netcdf4/HDF
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hdf_libs = "-L%s -lhdf5_hl -lhdf5" % spec["hdf5"].prefix.lib
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options.extend([
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"--with-netcdf-incs=-I%s" % spec["netcdf-fortran"].prefix.include,
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"--with-netcdf-libs=-L%s -lnetcdff -lnetcdf %s" % (
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spec["netcdf-fortran"].prefix.lib, hdf_libs),
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])
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configure(*options)
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make()
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make("check")
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make("install")
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