#include <pointgroupsymmetry.h>
Public Types | |
| typedef std::vector< int > | characterlineT |
Public Attributes | |
| std::map< std::string, characterlineT > | irreps_ |
| bool | is_abelian =true |
| currently always true More... | |
| std::vector< std::string > | mullikan_ |
| Mullikan symbols of the irreps. More... | |
| std::vector< pg_operator > | operators_ |
| symmetry operators More... | |
| int | order_ |
| order of the point group More... | |
| std::string | schoenflies_ |
| Schoenflies symbol of the point group. More... | |
Member Typedef Documentation
◆ characterlineT
| typedef std::vector<int> madness::charactertable::characterlineT |
Member Data Documentation
◆ irreps_
| std::map<std::string,characterlineT> madness::charactertable::irreps_ |
Referenced by madness::projector_irrep::apply_symmetry_operators(), main(), madness::projector_irrep::make_c1_table(), madness::projector_irrep::make_c2_table(), madness::projector_irrep::make_c2h_table(), madness::projector_irrep::make_c2v_table(), madness::projector_irrep::make_ci_table(), madness::projector_irrep::make_cs_table(), madness::projector_irrep::make_d2_table(), madness::projector_irrep::make_d2h_table(), madness::projector_irrep::print_character_table(), madness::projector_irrep::project_on_irreps(), madness::projector_irrep::reduce(), and test_projector().
◆ is_abelian
| bool madness::charactertable::is_abelian =true |
currently always true
Referenced by madness::TDHF::symmetrize().
◆ mullikan_
| std::vector<std::string> madness::charactertable::mullikan_ |
Mullikan symbols of the irreps.
Referenced by madness::projector_irrep::apply_symmetry_operators(), madness::TDHF::check_consistency(), madness::projector_irrep::get_all_irreps(), madness::projector_irrep::get_canonical_to_irrep_map(), madness::projector_irrep::make_c1_table(), madness::projector_irrep::make_c2_table(), madness::projector_irrep::make_c2h_table(), madness::projector_irrep::make_c2v_table(), madness::projector_irrep::make_ci_table(), madness::projector_irrep::make_cs_table(), madness::projector_irrep::make_d2_table(), madness::projector_irrep::make_d2h_table(), madness::projector_irrep::print_character_table(), and madness::projector_irrep::set_irrep().
◆ operators_
| std::vector<pg_operator> madness::charactertable::operators_ |
symmetry operators
Referenced by madness::projector_irrep::apply_symmetry_operators(), main(), madness::projector_irrep::make_c1_table(), madness::projector_irrep::make_c2_table(), madness::projector_irrep::make_c2h_table(), madness::projector_irrep::make_c2v_table(), madness::projector_irrep::make_ci_table(), madness::projector_irrep::make_cs_table(), madness::projector_irrep::make_d2_table(), madness::projector_irrep::make_d2h_table(), madness::projector_irrep::print_character_table(), madness::projector_irrep::project_on_irreps(), test_orthogonalization(), and test_projector().
◆ order_
| int madness::charactertable::order_ |
order of the point group
Referenced by madness::projector_irrep::apply_symmetry_operators(), main(), madness::projector_irrep::make_c1_table(), madness::projector_irrep::make_c2_table(), madness::projector_irrep::make_c2h_table(), madness::projector_irrep::make_c2v_table(), madness::projector_irrep::make_ci_table(), madness::projector_irrep::make_cs_table(), madness::projector_irrep::make_d2_table(), madness::projector_irrep::make_d2h_table(), madness::projector_irrep::project_on_irreps(), madness::projector_irrep::reduce(), test_orthogonalization(), and test_projector().
◆ schoenflies_
| std::string madness::charactertable::schoenflies_ |
Schoenflies symbol of the point group.
Referenced by madness::projector_irrep::apply_symmetry_operators(), madness::projector_irrep::get_pointgroup(), madness::projector_irrep::make_c1_table(), madness::projector_irrep::make_c2_table(), madness::projector_irrep::make_c2h_table(), madness::projector_irrep::make_c2v_table(), madness::projector_irrep::make_ci_table(), madness::projector_irrep::make_cs_table(), madness::projector_irrep::make_d2_table(), madness::projector_irrep::make_d2h_table(), madness::projector_irrep::print_character_table(), madness::projector_irrep::print_info(), madness::projector_irrep::project_on_irreps(), and madness::projector_irrep::set_irrep().
The documentation for this struct was generated from the following file:
