guess_kind.h File Reference

#include <optional>
#include <string>
#include <string_view>
#include <utility>
#include <vector>

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Namespaces
namespace	occ
namespace	occ::qm
	quantum mechanics/quantum chemistry functionality including Hartree-Fock and more

Enumerations
enum class	occ::qm::GuessKind {   occ::qm::Auto , occ::qm::Core , occ::qm::Soad , occ::qm::Sap ,   occ::qm::AtomicScf }
	Where the SCF starts from. More...

Functions
std::string_view	occ::qm::guess_kind_name (GuessKind kind)
const std::vector< std::pair< std::string, GuessKind > > &	occ::qm::guess_kind_names ()
	The names a user may write, and what each selects.
std::optional< GuessKind >	occ::qm::guess_kind_from_string (std::string_view name)
	Parse a guess name. Returns nothing for an unrecognised one.