# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/8635cf96-2b5c-451c-be94-d2f1b03e672c/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 [First-principles lattice thermal conductivity calculation for InBr2 / Pnna (52) / materials id 568108](https://mdr.nims.go.jp/datasets/677da8a1-f86a-4be9-86ce-3f3b1b3a4167) ## Fulltext elements: [In, Br]cutoff: 8.0pair_type: gaussianfeature_type: gtinvmodel_type: 3max_p: 2max_l: 8gtinv_order: 3gtinv_maxl: [8, 8]gtinv_sym: [0, 0]gtinv_version: 1electrostatic: 0mass: [114.8, 79.9]n_pair_params: 11pair_params:- [1.0, 0.0]- [1.0, 0.7777777777777778]- [1.0, 1.5555555555555556]- [1.0, 2.3333333333333335]- [1.0, 3.111111111111111]- [1.0, 3.888888888888889]- [1.0, 4.666666666666667]- [1.0, 5.444444444444445]- [1.0, 6.222222222222222]- [1.0, 7.0]- [0.0, 0.0]n_type_pairs: 3type_pairs:- atom_type_pair: [0, 0] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]- atom_type_pair: [0, 1] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]- atom_type_pair: [1, 1] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]type_full: 1type_indices: [0, 1]n_coeffs: 8283coeffs: [2.279373673136315e+05, 2.237524414367777e+00, 1.042395243080255e+00, 0.000000000000000e+00, 0.000000000000000e+00, 4.137809522689708e+03, -3.638054095012365e+07, 0.000000000000000e+00, 0.000000000000000e+00, 0.000000000000000e+00, -2.899518428600805e+04, 7.937782570769630e+06, 0.000000000000000e+00, 0.000000000000000e+00, 0.000000000000000e+00, -3.936236312896996e+03, 2.713683763477519e+07, 0.000000000000000e+00, 0.000000000000000e+00, 0.000000000000000e+00, 1.611171861563221e+03, 1.636202512348387e+07, 0.000000000000000e+00, 0.000000000000000e+00, 0.000000000000000e+00, 3.615075985687428e+03, 3.051783125907255e+06, 0.000000000000000e+00, 0.000000000000000e+00, 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