SIRIUS 7.5.0
Electronic structure library and applications
sirius::hubbard_orbital_descriptor Member List

This is the complete list of members for sirius::hubbard_orbital_descriptor, including all inherited members.

alpha() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
alpha_ (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorprivate
B() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
beta() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
beta_ (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorprivate
calculate_ak_coefficients(sddk::mdarray< double, 5 > &ak) (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinlineprivate
compute_hubbard_matrix()sirius::hubbard_orbital_descriptorinlineprivate
E2() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
E3() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
f() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
f_ (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorprivate
hubbard_coefficients_sirius::hubbard_orbital_descriptorprivate
hubbard_F_coefficients() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinlineprivate
hubbard_matrix(const int m1, const int m2, const int m3, const int m4) const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
hubbard_matrix(const int m1, const int m2, const int m3, const int m4) (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
hubbard_matrix_ (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorprivate
hubbard_orbital_descriptor()sirius::hubbard_orbital_descriptorinline
hubbard_orbital_descriptor(const int n__, const int l__, const int orbital_index__, const double occ__, const double J__, const double U__, const double *hub_coef__, const double alpha__, const double beta__, const double J0__, std::vector< double > initial_occupancy__, Spline< double > f__, bool use_for_calculations__, int idx_wf__)sirius::hubbard_orbital_descriptorinline
hubbard_orbital_descriptor(hubbard_orbital_descriptor &&src)sirius::hubbard_orbital_descriptorinline
idx_wf() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
idx_wf_sirius::hubbard_orbital_descriptorprivate
initial_occupancy() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
initial_occupancy_ (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorprivate
initialize_hubbard_matrix() (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinlineprivate
J() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
J0() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
J0_ (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorprivate
J_sirius::hubbard_orbital_descriptorprivate
l() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
l_sirius::hubbard_orbital_descriptorprivate
n() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
n_sirius::hubbard_orbital_descriptorprivate
occupancy() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
occupancy_sirius::hubbard_orbital_descriptorprivate
U() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
U_sirius::hubbard_orbital_descriptorprivate
U_minus_J() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
use_for_calculation() const (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline
use_for_calculation_sirius::hubbard_orbital_descriptorprivate
~hubbard_orbital_descriptor() (defined in sirius::hubbard_orbital_descriptor)sirius::hubbard_orbital_descriptorinline