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15391d84fe
modified: p/PETSc/PETSc-3.12.2-intel-2018a-it4i.eb new file: p/PETSc/PETSc-3.12.2-intel-2019a-it4i.eb modified: s/Singularity/Singularity-3.5.2.eb
57 lines
2.2 KiB
Plaintext
57 lines
2.2 KiB
Plaintext
# IT4Innovations 2019
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# kompilovat na cn
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easyblock = 'ConfigureMake'
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name = 'PETSc'
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version = '3.12.2'
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versionsuffix = '-it4i'
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homepage = 'http://www.mcs.anl.gov/petsc'
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description = """PETSc, pronounced PET-see (the S is silent), is a suite of data structures and routines for the
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scalable (parallel) solution of scientific applications modeled by partial differential equations."""
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toolchain = {'name': 'intel', 'version': '2019a'}
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# build is still parallel, PETSc make doesnt support -j opt
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maxparallel = 0
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source_urls = ['http://ftp.mcs.anl.gov/pub/petsc/release-snapshots']
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sources = [SOURCELOWER_TAR_GZ]
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# (build) dependencies provided through EasyBuild
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builddependencies = [('CMake', '3.16.0', '-rc3', True)]
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# configure installs dependencies -> remove installdir before configure
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keeppreviousinstall = True
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preconfigopts = 'rm -rf %(installdir)s;'
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petscArch = 'intel-opt'
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petscDir = '%(builddir)s/%(namelower)s-%(version)s'
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# config options
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configopts = '--CFLAGS=-O3 -xHost --CXXFLAGS=-O3 -xHost --FFLAGS=-O3 -xHost --with-c++-support --with-pic=1 '
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configopts += '--with-cc=mpicc --with-cxx=mpicxx --with-fc=mpif90 --with-debugging=0 --with-gnu-compilers=0 '
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configopts += '--with-mpi=1 --with-x=0 '
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configopts += '--download-metis --download-parmetis --download-mumps --download-superlu --download-superlu_dist '
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configopts += '--with-blas-lapack-lib=[$EBROOTIMKL/mkl/lib/intel64_lin/libmkl_intel_lp64.a,libmkl_sequential.a,libmkl_core.a] '
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configopts += '--with-scalapack-include=$EBROOTIMKL/mkl/include '
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configopts += '--with-scalapack-lib=[$EBROOTIMKL/mkl/lib/intel64_lin/libmkl_scalapack_lp64.a,libmkl_blacs_intelmpi_lp64.a,libmkl_intel_lp64.a,libmkl_sequential.a,libmkl_core.a] '
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configopts += '--with-scalapack=1 '
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configopts += 'PETSC_ARCH=%s' % petscArch
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installopts = 'PETSC_DIR=%s PETSC_ARCH=%s' % (petscDir, petscArch)
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buildopts = installopts + ' all'
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modextravars = {'PETSC_DIR': '%(installdir)s'}
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modextrapaths = {'PATH': 'lib/petsc/bin'}
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moduleclass = 'numlib'
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# sanity checks
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runtest = 'test' # run make test after make
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sanity_check_paths = {
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'files': ['include/petscconf.h', 'lib/libpetsc.so'],
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'dirs': []
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}
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sanity_check_commands = [('petscmpiexec', '-h')]
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