#include <concepts>
#include <occ/core/energy_components.h>
#include <occ/core/point_charge.h>
#include <occ/qm/mo.h>
#include <occ/qm/spinorbital.h>

Include dependency graph for scf_method.h:

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Classes
struct	occ::qm::FockBuildProperties
	What a method guarantees about its Fock build, so the SCF driver can decide whether to accumulate `F += G(ΔD)` instead of rebuilding from H each cycle. More...

class	occ::qm::SCFMethodBase

Namespaces
namespace	occ

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

Concepts
concept	occ::qm::SCFMethod

concept	occ::qm::DensityFittingMethod

concept	occ::qm::PointChargeMethod

Functions
constexpr bool	occ::qm::supports_incremental_fock_build (const FockBuildProperties &properties)
	F can only be accumulated when the build is linear and the core Hamiltonian is fixed; screening decides whether it is worth doing.

Variables
template<typename T >
constexpr bool	occ::qm::is_scf_method_v = SCFMethod<T>

template<typename T >
constexpr bool	occ::qm::supports_density_fitting_v = DensityFittingMethod<T>

template<typename T >
constexpr bool	occ::qm::supports_point_charges_v = PointChargeMethod<T>

Classes

Namespaces

Concepts

Functions

Variables