dealii: formatting
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0036483ded
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1 changed files with 73 additions and 61 deletions
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@ -25,8 +25,10 @@
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from spack import *
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import sys
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class Dealii(Package):
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"""C++ software library providing well-documented tools to build finite element codes for a broad variety of PDEs."""
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"""C++ software library providing well-documented tools to build finite
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element codes for a broad variety of PDEs."""
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homepage = "https://www.dealii.org"
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url = "https://github.com/dealii/dealii/releases/download/v8.4.0/dealii-8.4.0.tar.gz"
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@ -36,7 +38,7 @@ class Dealii(Package):
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variant('mpi', default=True, description='Compile with MPI')
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variant('arpack', default=True, description='Compile with Arpack and PArpack (only with MPI)')
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variant('doc', default=False, description='Compile with documentation')
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variant('gsl' , default=True, description='Compile with GSL')
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variant('gsl', default=True, description='Compile with GSL')
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variant('hdf5', default=True, description='Compile with HDF5 (only with MPI)')
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variant('metis', default=True, description='Compile with Metis')
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variant('netcdf', default=True, description='Compile with Netcdf (only with MPI)')
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@ -47,39 +49,40 @@ class Dealii(Package):
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variant('trilinos', default=True, description='Compile with Trilinos (only with MPI)')
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# required dependencies, light version
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depends_on ("blas")
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# Boost 1.58 is blacklisted, see https://github.com/dealii/dealii/issues/1591
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# require at least 1.59
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depends_on ("boost@1.59.0:+thread+system+serialization+iostreams", when='~mpi')
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depends_on ("boost@1.59.0:+mpi+thread+system+serialization+iostreams", when='+mpi')
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depends_on ("bzip2")
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depends_on ("cmake")
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depends_on ("lapack")
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depends_on ("muparser")
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depends_on ("suite-sparse")
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depends_on ("tbb")
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depends_on ("zlib")
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depends_on("blas")
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# Boost 1.58 is blacklisted, see
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# https://github.com/dealii/dealii/issues/1591
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# Require at least 1.59
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depends_on("boost@1.59.0:+thread+system+serialization+iostreams", when='~mpi') # NOQA: ignore=E501
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depends_on("boost@1.59.0:+mpi+thread+system+serialization+iostreams", when='+mpi') # NOQA: ignore=E501
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depends_on("bzip2")
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depends_on("cmake")
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depends_on("lapack")
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depends_on("muparser")
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depends_on("suite-sparse")
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depends_on("tbb")
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depends_on("zlib")
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# optional dependencies
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depends_on ("mpi", when="+mpi")
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depends_on ("arpack-ng+mpi", when='+arpack+mpi')
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depends_on ("doxygen+graphviz", when='+doc')
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depends_on ("graphviz", when='+doc')
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depends_on ("gsl", when='@8.5.0:+gsl')
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depends_on ("gsl", when='@dev+gsl')
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depends_on ("hdf5+mpi", when='+hdf5+mpi')
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depends_on ("metis@5:", when='+metis')
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depends_on ("netcdf+mpi", when="+netcdf+mpi")
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depends_on ("netcdf-cxx", when='+netcdf+mpi')
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depends_on ("oce", when='+oce')
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depends_on ("p4est", when='+p4est+mpi')
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depends_on ("petsc+mpi", when='+petsc+mpi')
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depends_on ("slepc", when='+slepc+petsc+mpi')
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depends_on ("trilinos", when='+trilinos+mpi')
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depends_on("mpi", when="+mpi")
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depends_on("arpack-ng+mpi", when='+arpack+mpi')
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depends_on("doxygen+graphviz", when='+doc')
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depends_on("graphviz", when='+doc')
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depends_on("gsl", when='@8.5.0:+gsl')
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depends_on("gsl", when='@dev+gsl')
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depends_on("hdf5+mpi", when='+hdf5+mpi')
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depends_on("metis@5:", when='+metis')
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depends_on("netcdf+mpi", when="+netcdf+mpi")
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depends_on("netcdf-cxx", when='+netcdf+mpi')
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depends_on("oce", when='+oce')
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depends_on("p4est", when='+p4est+mpi')
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depends_on("petsc+mpi", when='+petsc+mpi')
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depends_on("slepc", when='+slepc+petsc+mpi')
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depends_on("trilinos", when='+trilinos+mpi')
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# developer dependnecies
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depends_on ("numdiff", when='@dev')
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depends_on ("astyle@2.04", when='@dev')
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depends_on("numdiff", when='@dev')
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depends_on("astyle@2.04", when='@dev')
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def install(self, spec, prefix):
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options = []
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@ -97,9 +100,9 @@ def install(self, spec, prefix):
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'-DDEAL_II_WITH_THREADS:BOOL=ON',
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'-DBOOST_DIR=%s' % spec['boost'].prefix,
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'-DBZIP2_DIR=%s' % spec['bzip2'].prefix,
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# CMake's FindBlas/Lapack may pickup system's blas/lapack instead of Spack's.
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# Be more specific to avoid this.
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# Note that both lapack and blas are provided in -DLAPACK_XYZ variables
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# CMake's FindBlas/Lapack may pickup system's blas/lapack instead
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# of Spack's. Be more specific to avoid this.
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# Note that both lapack and blas are provided in -DLAPACK_XYZ.
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'-DLAPACK_FOUND=true',
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'-DLAPACK_INCLUDE_DIRS=%s;%s' %
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(spec['lapack'].prefix.include,
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@ -107,7 +110,7 @@ def install(self, spec, prefix):
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'-DLAPACK_LIBRARIES=%s;%s' %
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(spec['lapack'].lapack_shared_lib,
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spec['blas'].blas_shared_lib),
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'-DMUPARSER_DIR=%s ' % spec['muparser'].prefix,
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'-DMUPARSER_DIR=%s' % spec['muparser'].prefix,
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'-DUMFPACK_DIR=%s' % spec['suite-sparse'].prefix,
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'-DTBB_DIR=%s' % spec['tbb'].prefix,
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'-DZLIB_DIR=%s' % spec['zlib'].prefix
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@ -126,24 +129,25 @@ def install(self, spec, prefix):
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'-DDEAL_II_WITH_MPI:BOOL=OFF',
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])
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# Optional dependencies for which librariy names are the same as CMake variables
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for library in ('gsl','hdf5','p4est','petsc','slepc','trilinos','metis'):
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# Optional dependencies for which librariy names are the same as CMake
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# variables:
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for library in ('gsl', 'hdf5', 'p4est', 'petsc', 'slepc', 'trilinos', 'metis'): # NOQA: ignore=E501
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if library in spec:
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options.extend([
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'-D{library}_DIR={value}'.format(library=library.upper(), value=spec[library].prefix),
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'-DDEAL_II_WITH_{library}:BOOL=ON'.format(library=library.upper())
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'-D%s_DIR=%s' % (library.upper(), spec[library].prefix),
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'-DDEAL_II_WITH_%s:BOOL=ON' % library.upper()
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])
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else:
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options.extend([
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'-DDEAL_II_WITH_{library}:BOOL=OFF'.format(library=library.upper())
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'-DDEAL_II_WITH_%s:BOOL=OFF' % library.upper()
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])
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# doxygen
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options.extend([
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'-DDEAL_II_COMPONENT_DOCUMENTATION=%s' % ('ON' if '+doc' in spec else 'OFF'),
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'-DDEAL_II_COMPONENT_DOCUMENTATION=%s' %
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('ON' if '+doc' in spec else 'OFF'),
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])
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# arpack
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if '+arpack' in spec:
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options.extend([
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@ -161,11 +165,13 @@ def install(self, spec, prefix):
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options.extend([
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'-DNETCDF_FOUND=true',
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'-DNETCDF_LIBRARIES=%s;%s' %
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(join_path(spec['netcdf-cxx'].prefix.lib,'libnetcdf_c++.%s' % dsuf),
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join_path(spec['netcdf'].prefix.lib,'libnetcdf.%s' % dsuf)),
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(join_path(spec['netcdf-cxx'].prefix.lib,
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'libnetcdf_c++.%s' % dsuf),
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join_path(spec['netcdf'].prefix.lib,
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'libnetcdf.%s' % dsuf)),
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'-DNETCDF_INCLUDE_DIRS=%s;%s' %
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(spec['netcdf-cxx'].prefix.include,
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spec['netcdf'].prefix.include),
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spec['netcdf'].prefix.include),
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])
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else:
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options.extend([
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@ -201,7 +207,7 @@ def install(self, spec, prefix):
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with working_dir('examples/step-3'):
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cmake('.')
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make('release')
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make('run',parallel=False)
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make('run', parallel=False)
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# An example which uses Metis + PETSc
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# FIXME: switch step-18 to MPI
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if '^petsc' in spec and '^metis' in spec:
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cmake('.')
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make('release')
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make('run',parallel=False)
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make('run', parallel=False)
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# take step-40 which can use both PETSc and Trilinos
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# FIXME: switch step-40 to MPI run
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print('========== Step-40 PETSc ============')
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print('=====================================')
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# list the number of cycles to speed up
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filter_file(r'(const unsigned int n_cycles = 8;)', ('const unsigned int n_cycles = 2;'), 'step-40.cc')
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filter_file(r'(const unsigned int n_cycles = 8;)',
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('const unsigned int n_cycles = 2;'), 'step-40.cc')
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cmake('.')
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if '^petsc' in spec:
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make('release')
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make('run',parallel=False)
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make('run', parallel=False)
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print('=====================================')
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print('========= Step-40 Trilinos ==========')
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print('=====================================')
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# change Linear Algebra to Trilinos
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filter_file(r'(\/\/ #define FORCE_USE_OF_TRILINOS.*)', ('#define FORCE_USE_OF_TRILINOS'), 'step-40.cc')
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filter_file(r'(\/\/ #define FORCE_USE_OF_TRILINOS.*)',
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('#define FORCE_USE_OF_TRILINOS'), 'step-40.cc')
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if '^trilinos+hypre' in spec:
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make('release')
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make('run',parallel=False)
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make('run', parallel=False)
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print('=====================================')
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print('=== Step-40 Trilinos SuperluDist ====')
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print('=====================================')
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# change to direct solvers
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filter_file(r'(LA::SolverCG solver\(solver_control\);)', ('TrilinosWrappers::SolverDirect::AdditionalData data(false,"Amesos_Superludist"); TrilinosWrappers::SolverDirect solver(solver_control,data);'), 'step-40.cc')
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filter_file(r'(LA::MPI::PreconditionAMG preconditioner;)', (''), 'step-40.cc')
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filter_file(r'(LA::MPI::PreconditionAMG::AdditionalData data;)', (''), 'step-40.cc')
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filter_file(r'(preconditioner.initialize\(system_matrix, data\);)', (''), 'step-40.cc')
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filter_file(r'(solver\.solve \(system_matrix, completely_distributed_solution, system_rhs,)', ('solver.solve (system_matrix, completely_distributed_solution, system_rhs);'), 'step-40.cc')
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filter_file(r'(LA::SolverCG solver\(solver_control\);)', ('TrilinosWrappers::SolverDirect::AdditionalData data(false,"Amesos_Superludist"); TrilinosWrappers::SolverDirect solver(solver_control,data);'), 'step-40.cc') # NOQA: ignore=E501
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filter_file(r'(LA::MPI::PreconditionAMG preconditioner;)',
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(''), 'step-40.cc')
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filter_file(r'(LA::MPI::PreconditionAMG::AdditionalData data;)',
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(''), 'step-40.cc')
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filter_file(r'(preconditioner.initialize\(system_matrix, data\);)',
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(''), 'step-40.cc')
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filter_file(r'(solver\.solve \(system_matrix, completely_distributed_solution, system_rhs,)', ('solver.solve (system_matrix, completely_distributed_solution, system_rhs);'), 'step-40.cc') # NOQA: ignore=E501
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filter_file(r'(preconditioner\);)', (''), 'step-40.cc')
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if '^trilinos+superlu-dist' in spec:
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make('release')
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make('run',paralle=False)
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make('run', paralle=False)
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print('=====================================')
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print('====== Step-40 Trilinos MUMPS =======')
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print('=====================================')
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# switch to Mumps
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filter_file(r'(Amesos_Superludist)', ('Amesos_Mumps'), 'step-40.cc')
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filter_file(r'(Amesos_Superludist)',
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('Amesos_Mumps'), 'step-40.cc')
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if '^trilinos+mumps' in spec:
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make('release')
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make('run',parallel=False)
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make('run', parallel=False)
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print('=====================================')
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print('============ Step-36 ================')
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@ -268,7 +280,7 @@ def install(self, spec, prefix):
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if 'slepc' in spec:
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cmake('.')
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make('release')
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make('run',parallel=False)
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make('run', parallel=False)
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print('=====================================')
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print('============ Step-54 ================')
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@ -277,7 +289,7 @@ def install(self, spec, prefix):
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if 'oce' in spec:
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cmake('.')
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make('release')
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make('run',parallel=False)
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make('run', parallel=False)
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def setup_environment(self, spack_env, env):
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env.set('DEAL_II_DIR', self.prefix)
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