pyscf.dft.xc package¶
Submodules¶
pyscf.dft.xc.utils module¶
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pyscf.dft.xc.utils.format_xc_code(description)¶ Format the description (removing white space) then convert the RSH(omega, alpha, beta) notation to the internal notation RSH(alpha; beta; omega)
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pyscf.dft.xc.utils.remove_dup(fn_facs)¶