spgrep-modulation 0.2.6
Contents
Introduction
Examples
Sewing band structure by subduced representation
Visualize modulated structures with nglview
Formulation
Lattice vibration
Isotropy subgroup
API reference
Modulation
Irreps
Isotropy subgroup
Change log
Implementation notes
Symmetry condition for group velocity
Supercell construction
Band connectivity
Index
A
|
D
|
E
|
G
|
I
|
L
|
M
|
O
|
P
|
Q
|
S
|
U
|
W
A
apply_modulation_to_supercell() (spgrep_modulation.modulation.Modulation method)
D
degeneracy_tolerance (spgrep_modulation.modulation.Modulation property)
dynamical_matrix (spgrep_modulation.modulation.Modulation property)
E
eigenspaces (spgrep_modulation.modulation.Modulation property)
eigvals_to_frequencies() (spgrep_modulation.modulation.Modulation method)
enumerate_point_subgroup() (in module spgrep_modulation.isotropy)
G
get_eigenmode_representation() (in module spgrep_modulation.irreps)
get_high_symmetry_modulated_supercells() (spgrep_modulation.modulation.Modulation method)
get_modulated_supercell_and_modulation() (spgrep_modulation.modulation.Modulation method)
get_modulated_supercells() (spgrep_modulation.modulation.Modulation method)
get_translational_subgroup() (in module spgrep_modulation.isotropy)
I
IsotropyEnumerator (class in spgrep_modulation.isotropy)
L
little_rotations (spgrep_modulation.isotropy.IsotropyEnumerator property)
(spgrep_modulation.modulation.Modulation property)
little_translations (spgrep_modulation.isotropy.IsotropyEnumerator property)
(spgrep_modulation.modulation.Modulation property)
M
maximal_isotropy_subgroups (spgrep_modulation.isotropy.IsotropyEnumerator property)
Modulation (class in spgrep_modulation.modulation)
O
order_parameter_directions (spgrep_modulation.isotropy.IsotropyEnumerator property)
P
primitive (spgrep_modulation.modulation.Modulation property)
primitive_symmetry (spgrep_modulation.modulation.Modulation property)
project_eigenmode_representation() (in module spgrep_modulation.irreps)
Q
qpoint (spgrep_modulation.isotropy.IsotropyEnumerator property)
(spgrep_modulation.modulation.Modulation property)
S
search_compliment() (in module spgrep_modulation.isotropy)
small_rep (spgrep_modulation.isotropy.IsotropyEnumerator property)
supercell (spgrep_modulation.modulation.Modulation property)
U
unit_conversion_factor (spgrep_modulation.modulation.Modulation property)
W
with_supercell_and_symmetry_search() (spgrep_modulation.modulation.Modulation class method)