# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/52f15683-6ca2-48c7-bb36-eb1ff22650d7/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 Tl3AsO4 / P6_3 (173) / materials id 15573](https://mdr.nims.go.jp/datasets/464c8a72-b768-4b99-a86e-574463e180ca) ## Fulltext phonopy: version: 2.17.1 frequency_unit_conversion_factor: 15.633302 symmetry_tolerance: 1.00000e-05 nac_unit_conversion_factor: 14.399652 configuration: save_params: ".true."physical_unit: atomic_mass: "AMU" length: "angstrom" force_constants: "eV/angstrom^2"space_group: type: "P6_3" number: 173 Hall_symbol: "P 6c"supercell_matrix:- [ 2, 0, 0 ]- [ 0, 2, 0 ]- [ 0, 0, 2 ]primitive_cell: lattice: - [ 8.602032130000000, -0.000000100000000, 0.000000000000000 ] # a - [ -4.301015970000000, 7.449578390000000, 0.000000000000000 ] # b - 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