Index _ | A | B | C | D | E | F | G | M | O | P | R | S | T | W _ __all__ (in module castepxbin.castep_bin) (in module castepxbin.ome_bin) (in module castepxbin.pdos) __float__() (castepxbin.pdos.SpinEnum method) __int__() (castepxbin.pdos.OrbitalEnum method) (castepxbin.pdos.SpinEnum method) __str__() (castepxbin.pdos.OrbitalEnum method) (castepxbin.pdos.OrbitalType method) (castepxbin.pdos.SpinEnum method) __version__ (in module castepxbin) _decode_composite() (in module castepxbin.castep_bin) _decode_records() (in module castepxbin.castep_bin) _find_header_suffix() (in module castepxbin.castep_bin) _generate_header_offset_map() (in module castepxbin.castep_bin) _merge_weights() (in module castepxbin.pdos) _read_marker() (in module castepxbin.castep_bin) _read_record() (in module castepxbin.castep_bin) A ArrayField (class in castepxbin.castep_bin) B BoolField (class in castepxbin.castep_bin) C CASTEP_BIN_FIELD_SHAPES (in module castepxbin.castep_bin) CASTEP_BIN_FIELD_SPEC (in module castepxbin.castep_bin) CASTEP_CHECK_FIELD_SPEC (in module castepxbin.castep_bin) castepxbin module castepxbin.castep_bin module castepxbin.ome_bin module castepxbin.pdos module castepxbin.wave module ChargeDensityField (class in castepxbin.castep_bin) coeff_to_recip() (in module castepxbin.wave) CompositeField (class in castepxbin.castep_bin) compute_pdos() (in module castepxbin.pdos) coords_to_indices() (in module castepxbin.wave) D d (castepxbin.pdos.OrbitalType attribute) decode() (castepxbin.castep_bin.ArrayField method) (castepxbin.castep_bin.BoolField method) (castepxbin.castep_bin.ChargeDensityField method) (castepxbin.castep_bin.EigenValueAndOccCompositeField method) (castepxbin.castep_bin.FieldType method) (castepxbin.castep_bin.ScalarField method) (castepxbin.castep_bin.SkippedField method) (castepxbin.castep_bin.StrField method) (castepxbin.castep_bin.WaveFunctionField static method) dx2 (castepxbin.pdos.OrbitalEnum attribute) dxy (castepxbin.pdos.OrbitalEnum attribute) dxz (castepxbin.pdos.OrbitalEnum attribute) dyz (castepxbin.pdos.OrbitalEnum attribute) dz2 (castepxbin.pdos.OrbitalEnum attribute) E EigenValueAndOccCompositeField (class in castepxbin.castep_bin) F f (castepxbin.pdos.OrbitalType attribute) f_x_yy_zz (castepxbin.pdos.OrbitalEnum attribute) f_xxx (castepxbin.pdos.OrbitalEnum attribute) f_xyz (castepxbin.pdos.OrbitalEnum attribute) f_y_zz_xx (castepxbin.pdos.OrbitalEnum attribute) f_yyy (castepxbin.pdos.OrbitalEnum attribute) f_z_xx_yy (castepxbin.pdos.OrbitalEnum attribute) f_zzz (castepxbin.pdos.OrbitalEnum attribute) FieldType (class in castepxbin.castep_bin) from_dict() (castepxbin.wave.WaveFunction class method) from_file() (castepxbin.wave.WaveFunction class method) G get_gmesh_index() (castepxbin.wave.WaveFunction method) get_gvectors() (castepxbin.wave.WaveFunction method) get_kpoints_cart() (castepxbin.wave.WaveFunction method) get_plane_wave_coeffs() (castepxbin.wave.WaveFunction method) get_reciprocal_grid() (castepxbin.wave.WaveFunction method) M module castepxbin castepxbin.castep_bin castepxbin.ome_bin castepxbin.pdos castepxbin.wave O orbital_type (castepxbin.pdos.OrbitalEnum property) OrbitalEnum (class in castepxbin.pdos) OrbitalType (class in castepxbin.pdos) P p (castepxbin.pdos.OrbitalType attribute) px (castepxbin.pdos.OrbitalEnum attribute) py (castepxbin.pdos.OrbitalEnum attribute) pz (castepxbin.pdos.OrbitalEnum attribute) R read_castep_bin() (in module castepxbin.castep_bin) read_cst_ome() (in module castepxbin.ome_bin) read_dome_bin() (in module castepxbin.ome_bin) read_ome_bin() (in module castepxbin.ome_bin) read_pdos_bin() (in module castepxbin.pdos) reorder_pdos_data() (in module castepxbin.pdos) resolve_shape() (castepxbin.castep_bin.ArrayField method) S s (castepxbin.pdos.OrbitalEnum attribute) (castepxbin.pdos.OrbitalType attribute) ScalarField (class in castepxbin.castep_bin) shape (castepxbin.castep_bin.ArrayField property) (castepxbin.castep_bin.ScalarField property) SkippedField (class in castepxbin.castep_bin) SpinEnum (class in castepxbin.pdos) STORE_COEFFS (castepxbin.castep_bin.WaveFunctionField attribute) StrField (class in castepxbin.castep_bin) StructuredField (class in castepxbin.castep_bin) T TYPE_MAP (in module castepxbin.castep_bin) W WaveFunction (class in castepxbin.wave) WaveFunctionField (class in castepxbin.castep_bin)
