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24 lines
950 B
Plaintext
24 lines
950 B
Plaintext
name = 'Libint'
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version = '1.1.4'
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homepage = 'https://sourceforge.net/p/libint/'
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description = """Libint library is used to evaluate the traditional (electron repulsion) and certain novel two-body
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matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory."""
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toolchain = {'name': 'goolf', 'version': '1.5.16'}
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toolchainopts = {'opt': True, 'optarch': True, 'pic': True}
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sources = [SOURCELOWER_TAR_GZ]
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source_urls = ('http://sourceforge.net/projects/libint/files/v1-releases/', 'download')
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configopts = "--enable-deriv --enable-r12"
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sanity_check_paths = {
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'files': ['include/lib%(x)s/lib%(x)s.h' % {'x': x} for x in ['deriv', 'int', 'r12']] +
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['include/libint/hrr_header.h', 'include/libint/vrr_header.h'] +
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['lib/lib%s.a' % x for x in ['deriv', 'int', 'r12']] +
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['lib/lib%s.so' % x for x in ['deriv', 'int', 'r12']],
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'dirs':[],
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}
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moduleclass = 'chem'
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