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SIRIUS 7.5.0
Electronic structure library and applications
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This is the complete list of members for sirius::Atom, including all inherited members.
| apply_uj_correction() (defined in sirius::Atom) | sirius::Atom | inline |
| apply_uj_correction_ | sirius::Atom | private |
| Atom(Atom_type const &type__, r3::vector< double > position__, r3::vector< double > vector_field__) | sirius::Atom | inline |
| b_radial_integrals(int idxrf1, int idxrf2, int x) const (defined in sirius::Atom) | sirius::Atom | inline |
| b_radial_integrals_ | sirius::Atom | private |
| beff_ | sirius::Atom | private |
| d_mtrx(int xi1, int xi2, int iv) (defined in sirius::Atom) | sirius::Atom | inline |
| d_mtrx(int xi1, int xi2, int iv) const (defined in sirius::Atom) | sirius::Atom | inline |
| d_mtrx() const (defined in sirius::Atom) | sirius::Atom | inline |
| d_mtrx() (defined in sirius::Atom) | sirius::Atom | inline |
| d_mtrx_ | sirius::Atom | private |
| generate_radial_integrals(sddk::device_t pu__, mpi::Communicator const &comm__) | sirius::Atom | inline |
| get_occupation_matrix(std::complex< double > *destination) (defined in sirius::Atom) | sirius::Atom | inline |
| h_radial_integrals(int idxrf1, int idxrf2) const (defined in sirius::Atom) | sirius::Atom | inline |
| h_radial_integrals(int idxrf1, int idxrf2) (defined in sirius::Atom) | sirius::Atom | inline |
| h_radial_integrals_ | sirius::Atom | private |
| init() | sirius::Atom | inline |
| lmax_pot_ | sirius::Atom | private |
| mt_aw_basis_size() const (defined in sirius::Atom) | sirius::Atom | inline |
| mt_basis_size() const (defined in sirius::Atom) | sirius::Atom | inline |
| mt_lo_basis_size() const (defined in sirius::Atom) | sirius::Atom | inline |
| mt_radius() const (defined in sirius::Atom) | sirius::Atom | inline |
| num_mt_points() const (defined in sirius::Atom) | sirius::Atom | inline |
| occupation_matrix_ | sirius::Atom | private |
| position() const | sirius::Atom | inline |
| position_ | sirius::Atom | private |
| radial_grid() const (defined in sirius::Atom) | sirius::Atom | inline |
| radial_grid(int idx) const (defined in sirius::Atom) | sirius::Atom | inline |
| radial_integrals_sum_L3(int idxrf1__, int idxrf2__, std::vector< gaunt_L3< std::complex< double > > > const &gnt__) const | sirius::Atom | inline |
| set_nonspherical_potential(double *veff__, double *beff__[3]) | sirius::Atom | inline |
| set_occupation_matrix(const std::complex< double > *source) (defined in sirius::Atom) | sirius::Atom | inline |
| set_position(r3::vector< double > position__) | sirius::Atom | inline |
| set_symmetry_class(std::shared_ptr< Atom_symmetry_class > symmetry_class__) | sirius::Atom | inline |
| set_uj_correction_matrix(const int l, const std::complex< double > *source) (defined in sirius::Atom) | sirius::Atom | inline |
| symmetry_class() | sirius::Atom | inline |
| symmetry_class() const | sirius::Atom | inline |
| symmetry_class_ | sirius::Atom | private |
| symmetry_class_id() const | sirius::Atom | inline |
| sync_occupation_matrix(mpi::Communicator const &comm__, int const rank__) (defined in sirius::Atom) | sirius::Atom | inline |
| sync_radial_integrals(mpi::Communicator const &comm__, int const rank__) (defined in sirius::Atom) | sirius::Atom | inline |
| type() const | sirius::Atom | inline |
| type_ | sirius::Atom | private |
| type_id() const | sirius::Atom | inline |
| uj_correction_l() (defined in sirius::Atom) | sirius::Atom | inline |
| uj_correction_l_ | sirius::Atom | private |
| uj_correction_matrix(int lm1, int lm2, int ispn1, int ispn2) (defined in sirius::Atom) | sirius::Atom | inline |
| uj_correction_matrix_ | sirius::Atom | private |
| vector_field() const | sirius::Atom | inline |
| vector_field_ | sirius::Atom | private |
| veff_ | sirius::Atom | private |
| zn() const (defined in sirius::Atom) | sirius::Atom | inline |
1.9.3