Index A | B | C | D | E | F | G | H | I | L | M | N | P | Q | R | S | T | U | V | W | Z A auto_band_structure() (phonopy.Phonopy method) auto_projected_dos() (phonopy.Phonopy method) auto_total_dos() (phonopy.Phonopy method) B band_structure (phonopy.Phonopy property) C calculator (phonopy.Phonopy property) cell (phonopy.structure.atoms.PhonopyAtoms property) copy() (phonopy.Phonopy method) (phonopy.structure.atoms.PhonopyAtoms method) D dataset (phonopy.Phonopy property) develop_mlp() (phonopy.Phonopy method) displacements (phonopy.Phonopy property) dynamic_structure_factor (phonopy.Phonopy property) dynamical_matrix (phonopy.Phonopy property) E evaluate_mlp() (phonopy.Phonopy method) F force_constants (phonopy.Phonopy property) forces (phonopy.Phonopy property) formula (phonopy.structure.atoms.PhonopyAtoms property) G generate_displacements() (phonopy.Phonopy method) get_band_structure_dict() (phonopy.Phonopy method) get_Debye_frequency() (phonopy.Phonopy method) get_dynamic_structure_factor() (phonopy.Phonopy method) get_dynamical_matrix_at_q() (phonopy.Phonopy method) get_frequencies() (phonopy.Phonopy method) get_frequencies_with_eigenvectors() (phonopy.Phonopy method) get_group_velocity_at_q() (phonopy.Phonopy method) get_mesh_dict() (phonopy.Phonopy method) get_modulated_supercells() (phonopy.Phonopy method) get_modulations_and_supercell() (phonopy.Phonopy method) get_moment() (phonopy.Phonopy method) get_projected_dos_dict() (phonopy.Phonopy method) get_qpoints_dict() (phonopy.Phonopy method) get_random_displacements_at_temperature() (phonopy.Phonopy method) get_thermal_displacement_matrices_dict() (phonopy.Phonopy method) get_thermal_displacements_dict() (phonopy.Phonopy method) get_thermal_properties_dict() (phonopy.Phonopy method) get_total_dos_dict() (phonopy.Phonopy method) get_yaml_lines() (phonopy.structure.atoms.PhonopyAtoms method) group_velocity (phonopy.Phonopy property) H has_mixtures (phonopy.structure.atoms.PhonopyAtoms property) I init_dynamic_structure_factor() (phonopy.Phonopy method) init_mesh() (phonopy.Phonopy method) init_random_displacements() (phonopy.Phonopy method) irreps (phonopy.Phonopy property) L lang (phonopy.Phonopy property) load() (in module phonopy) load_mlp() (phonopy.Phonopy method) M magnetic_moments (phonopy.structure.atoms.PhonopyAtoms property) masses (phonopy.Phonopy property) (phonopy.structure.atoms.PhonopyAtoms property) mesh (phonopy.Phonopy property) mesh_numbers (phonopy.Phonopy property) mlp (phonopy.Phonopy property) mlp_dataset (phonopy.Phonopy property) moment (phonopy.Phonopy property) N nac_params (phonopy.Phonopy property) normalized_formula (phonopy.structure.atoms.PhonopyAtoms property) numbers (phonopy.structure.atoms.PhonopyAtoms property) P ph2ph() (phonopy.Phonopy method) Phonopy (class in phonopy) PhonopyAtoms (class in phonopy.structure.atoms) plot_band_structure() (phonopy.Phonopy method) plot_band_structure_and_dos() (phonopy.Phonopy method) plot_projected_dos() (phonopy.Phonopy method) plot_thermal_displacements() (phonopy.Phonopy method) plot_thermal_properties() (phonopy.Phonopy method) plot_total_dos() (phonopy.Phonopy method) positions (phonopy.structure.atoms.PhonopyAtoms property) primitive (phonopy.Phonopy property) primitive_matrix (phonopy.Phonopy property) primitive_symmetry (phonopy.Phonopy property) produce_force_constants() (phonopy.Phonopy method) projected_dos (phonopy.Phonopy property) Q qpoints (phonopy.Phonopy property) R random_displacements (phonopy.Phonopy property) read_crystal_structure() (in module phonopy.interface.calculator) reduced_formula (phonopy.structure.atoms.PhonopyAtoms property) run_band_structure() (phonopy.Phonopy method) run_dynamic_structure_factor() (phonopy.Phonopy method) run_mesh() (phonopy.Phonopy method) run_modulations() (phonopy.Phonopy method) run_moment() (phonopy.Phonopy method) run_projected_dos() (phonopy.Phonopy method) run_qpoints() (phonopy.Phonopy method) run_thermal_displacement_matrices() (phonopy.Phonopy method) run_thermal_displacements() (phonopy.Phonopy method) run_thermal_properties() (phonopy.Phonopy method) run_total_dos() (phonopy.Phonopy method) S save() (phonopy.Phonopy method) save_mlp() (phonopy.Phonopy method) scaled_positions (phonopy.structure.atoms.PhonopyAtoms property) set_Debye_frequency() (phonopy.Phonopy method) set_force_constants_zero_with_radius() (phonopy.Phonopy method) set_irreps() (phonopy.Phonopy method) show_irreps() (phonopy.Phonopy method) species_ids (phonopy.structure.atoms.PhonopyAtoms property) species_table (phonopy.structure.atoms.PhonopyAtoms property) supercell (phonopy.Phonopy property) supercell_energies (phonopy.Phonopy property) supercell_matrix (phonopy.Phonopy property) supercells_with_displacements (phonopy.Phonopy property) symbols (phonopy.structure.atoms.PhonopyAtoms property) symmetrize_force_constants() (phonopy.Phonopy method) symmetrize_force_constants_by_space_group() (phonopy.Phonopy method) symmetry (phonopy.Phonopy property) T thermal_displacement_matrices (phonopy.Phonopy property) thermal_displacements (phonopy.Phonopy property) thermal_properties (phonopy.Phonopy property) to_phonopy_yaml() (phonopy.Phonopy method) total_dos (phonopy.Phonopy property) totuple() (phonopy.structure.atoms.PhonopyAtoms method) U unit_conversion_factor (phonopy.Phonopy property) unitcell (phonopy.Phonopy property) V version (phonopy.Phonopy property) volume (phonopy.structure.atoms.PhonopyAtoms property) W write_animation() (phonopy.Phonopy method) write_crystal_structure() (in module phonopy.interface.calculator) write_hdf5_band_structure() (phonopy.Phonopy method) write_hdf5_mesh() (phonopy.Phonopy method) write_hdf5_qpoints_phonon() (phonopy.Phonopy method) write_modulations() (phonopy.Phonopy method) write_projected_dos() (phonopy.Phonopy method) write_thermal_displacement_matrix_to_cif() (phonopy.Phonopy method) write_total_dos() (phonopy.Phonopy method) write_yaml_band_structure() (phonopy.Phonopy method) write_yaml_irreps() (phonopy.Phonopy method) write_yaml_mesh() (phonopy.Phonopy method) write_yaml_modulations() (phonopy.Phonopy method) write_yaml_qpoints_phonon() (phonopy.Phonopy method) write_yaml_thermal_displacement_matrices() (phonopy.Phonopy method) write_yaml_thermal_displacements() (phonopy.Phonopy method) write_yaml_thermal_properties() (phonopy.Phonopy method) Z Z (phonopy.structure.atoms.PhonopyAtoms property)