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| -rw-r--r-- | var/spack/repos/builtin/packages/shengbte/package.py | 39 |
1 files changed, 39 insertions, 0 deletions
diff --git a/var/spack/repos/builtin/packages/shengbte/package.py b/var/spack/repos/builtin/packages/shengbte/package.py new file mode 100644 index 0000000000..59697a51ce --- /dev/null +++ b/var/spack/repos/builtin/packages/shengbte/package.py @@ -0,0 +1,39 @@ +# Copyright 2013-2020 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 Shengbte(MakefilePackage): + """ShengBTE is a software package for solving the Boltzmann Transport + Equation for phonons.""" + + homepage = "www.shengbte.org" + url = "www.shengbte.org/downloads/ShengBTE-v1.1.1-8a63749.tar.bz2" + + version('1.1.1-8a63749', sha256='43920740d19ae854c8ecae0b648acfdf1d7726ca4c2b44f1a1684457f2f88522') + + depends_on('mpi') + depends_on('spglib') + depends_on('mkl') + + parallel = False + + build_directory = 'Src' + + def edit(self, spec, prefix): + arch_make = join_path(self.build_directory, 'arch.make') + copy('arch.make.example', arch_make) + filter_file('export FFLAGS=.*', 'export FFLAGS=-debug -O2', arch_make) + filter_file('export LDFLAGS=.*', 'export LDFLAGS=' + spec['spglib']. + libs.ld_flags, arch_make) + + filter_file('export MPIFC=.*', 'export MPIFC=%s' % spec['mpi'].mpifc, + arch_make) + filter_file('LAPACK=.*', 'LAPACK=' + spec['mkl'].libs.ld_flags, + arch_make) + + def install(self, spec, prefix): + mkdirp(prefix.bin) + install('ShengBTE', prefix.bin) |