"exchange_method",
}
_dft_keywords_extra: Set[str] = _scf_keywords_extra.copy()
_hf_keywords_extra: Set[str] = _scf_keywords_extra.copy()
_xtb_keywords_extra: Set[str] = {}
// Energy commands that are currently supported and their available keywords
_energy_commands: Dict[str, Any] = {
After Change
"WB97XD3",
}
_xtb_models: Set[str] = {"GFN1", "GFN0"}
// This map order converts qcore ordering to CCA ordering
// Entos spherical basis ordering for each angular momentum. Follows reverse order of CCA.
_qcore_to_cca_ao_order = {"spherical": get_ao_conversion(cca_ao_order_spherical(10), qcore_ao_order_spherical(10))}
