get_phonon_supercell

atomate2.common.jobs.anharmonicity.get_phonon_supercell(structure, supercell_matrix)[source]

Get the phonon supercell of a structure.

Parameters:
  • structure (Structure) – The structure to get phonon supercell for

  • supercell_matrix (np.ndarray) – Supercell matrix for the phonon

Returns:

The phonopy structure

Return type:

Structure