# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/ed95c2d8-3ef3-42a6-8a54-a14e4d5a5141/download) ## Creator [Atsushi Togo](https://orcid.org/0000-0001-8393-9766) ## Rights Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/) ## Other metadata [Ab-initio phonon calculation for Nb(PS4)2 / P-4n2 (118) / materials id 28130](https://mdr.nims.go.jp/datasets/b58b94d3-2f7b-4f45-8d00-25084f417a91) ## Fulltext phonopy: version: 2.17.1 frequency_unit_conversion_factor: 15.633302 symmetry_tolerance: 1.00000e-05 configuration: save_params: ".true."physical_unit: atomic_mass: "AMU" length: "angstrom" force_constants: "eV/angstrom^2"space_group: type: "P-4n2" number: 118 Hall_symbol: "P -4 -2n"supercell_matrix:- [ 1, 0, 0 ]- [ 0, 1, 0 ]- [ 0, 0, 2 ]primitive_cell: lattice: - [ 12.022431170000001, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 12.022431170000001, 0.000000000000000 ] # b - 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