name = 'Libint' version = '1.1.4' homepage = 'https://sourceforge.net/p/libint/' description = """Libint library is used to evaluate the traditional (electron repulsion) and certain novel two-body matrix elements (integrals) over Cartesian Gaussian functions used in modern atomic and molecular theory.""" toolchain = {'name': 'CrayGNU', 'version': '2015.11'} toolchainopts = {'opt': True, 'pic': True} sources = [SOURCELOWER_TAR_GZ] source_urls = ('http://sourceforge.net/projects/libint/files/v1-releases/', 'download') configopts = "--enable-deriv --enable-r12" sanity_check_paths = { 'files': ['include/lib%(x)s/lib%(x)s.h' % {'x': x} for x in ['deriv', 'int', 'r12']] + ['include/libint/hrr_header.h', 'include/libint/vrr_header.h'] + ['lib/lib%s.a' % x for x in ['deriv', 'int', 'r12']] + ['lib/lib%s.so' % x for x in ['deriv', 'int', 'r12']], 'dirs':[], } moduleclass = 'chem'