# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/9fb96e9d-d320-4897-a7c6-704bd5ca5d32/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 Nb3H12C4NCl9 / P-3m1 (164) / materials id 569921](https://mdr.nims.go.jp/datasets/280a0949-51a1-4581-9bb5-75f691e711cd) ## 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-3m1" number: 164 Hall_symbol: "-P 3 2\""supercell_matrix:- [ 1, 0, 0 ]- [ 0, 1, 0 ]- [ 0, 0, 2 ]primitive_cell: lattice: - [ 10.914445140000000, 0.000000000000000, 0.000000000000000 ] # a - [ -5.457222570000000, 9.452186760000000, 0.000000000000000 ] # b - 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