# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/70a5bf1e-f55a-47a7-afe3-1c77aa8560f0/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 Mg2TiO4 / P4_122 (91) / materials id 757031](https://mdr.nims.go.jp/datasets/f23d0e73-16b6-44df-a5a4-f9b45cee341c) ## 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: "P4_122" number: 91 Hall_symbol: "P 4w 2c"supercell_matrix:- [ 2, 0, 0 ]- [ 0, 2, 0 ]- [ 0, 0, 1 ]primitive_cell: lattice: - [ 5.986880570000000, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 5.986880570000000, 0.000000000000000 ] # b - 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