# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/988d326b-83e2-45f7-94ea-c296b2112143/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 SbO2F / C2/c (15) / materials id 752753](https://mdr.nims.go.jp/datasets/de69c6b9-775e-49d9-a807-aa32cff1f3b8) ## Fulltext elements: [Sb, O, F]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: [121.8, 16.0, 19.0]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: 6type_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: [0, 2] 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]- atom_type_pair: [1, 2] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]- atom_type_pair: [2, 2] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]type_full: 1type_indices: [0, 1, 2]n_coeffs: 38511coeffs: [-5.361574753634067e+03, -1.314768673684631e-01, 1.593565700949581e-01, 7.322189162151522e+00, -2.108805024329718e+00, -7.713899143996353e-01, 0.000000000000000e+00, 2.479568576920827e+06, 7.166249226064273e+05, 8.207852230350186e+00, 3.349223530887850e+01, 1.738348053573793e+03, 7.684834204114965e+02, 2.747758043654910e+01, -1.022604559810432e+03, 5.466964778929714e+02, 1.801893943354761e+04, -3.315194215382772e+04, 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