# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/5bf2e700-c234-4c82-90e0-4a40b1021cba/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 Ca3La3(BO3)5 / P6_3mc (186) / materials id 6709](https://mdr.nims.go.jp/datasets/7561d391-57a3-4d09-88b9-86c7121b0876) ## 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_3mc" number: 186 Hall_symbol: "P 6c -2c"supercell_matrix:- [ 1, 0, 0 ]- [ 0, 1, 0 ]- [ 0, 0, 2 ]primitive_cell: lattice: - [ 10.465620280000000, 0.000000000000000, 0.000000000000000 ] # a - [ -5.232810140000000, 9.063493019999999, 0.000000000000000 ] # b - 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