# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/649df69f-f0dc-4a3b-b17e-d83e50d22a9c/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 K3IrCl6 / P2_1/c (14) / materials id 541141](https://mdr.nims.go.jp/datasets/238268c7-731b-4e46-a0a7-e743825a977d) ## 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: "P2_1/c" number: 14 Hall_symbol: "-P 2ybc"supercell_matrix:- [ 1, 0, 0 ]- [ 0, 2, 0 ]- [ 0, 0, 1 ]primitive_cell: lattice: - [ 12.498765680000000, 0.000000000000000, 0.056441050000000 ] # a - [ 0.000000000000000, 7.486824550000000, 0.000000000000000 ] # b - 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