# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/ffb3ae9d-381e-4d50-b924-94c4bddb1960/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 CaH2CO4 / P3_1 (144) / materials id 560832](https://mdr.nims.go.jp/datasets/59494821-2960-48c7-a1b6-a8b2b59a8b80) ## 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: "P3_1" number: 144 Hall_symbol: "P 31"supercell_matrix:- [ 1, 0, 0 ]- [ 0, 1, 0 ]- [ 0, 0, 2 ]primitive_cell: lattice: - [ 10.419904499999999, 0.000000000000000, 0.000000000000000 ] # a - [ -5.209952240000000, 9.023902010000000, 0.000000000000000 ] # b - 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