# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/51b14cbd-5fe8-4347-83a6-2d7b2b1a92ed/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 Mg3Si2H4O9 / P6_3cm (185) / materials id 24097](https://mdr.nims.go.jp/datasets/b26a8ed4-02c8-4c1b-8eb3-49c2cd71ec01) ## 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: "P6_3cm" number: 185 Hall_symbol: "P 6c -2"supercell_matrix:- [ 2, 0, 0 ]- [ 0, 2, 0 ]- [ 0, 0, 1 ]primitive_cell: lattice: - [ 5.326332270000000, 0.000000000000000, 0.000000000000000 ] # a - [ -2.663166140000000, 4.612739050000000, 0.000000000000000 ] # b - 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