# Fileset [phonopy_params.yaml.xz](https://mdr.nims.go.jp/filesets/6080794f-8edc-4255-8311-d8fb3d9d0879/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 Ba2B5ClO9 / Pnn2 (34) / materials id 555742](https://mdr.nims.go.jp/datasets/83f79e22-350e-4fae-8eca-f3d386bf4f5e) ## 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: "Pnn2" number: 34 Hall_symbol: "P 2 -2n"supercell_matrix:- [ 1, 0, 0 ]- [ 0, 1, 0 ]- [ 0, 0, 2 ]primitive_cell: lattice: - [ 11.597541290000001, 0.000000000000000, 0.000000000000000 ] # a - [ 0.000000000000000, 11.660272800000000, 0.000000000000000 ] # b - 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