# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/1e376a9e-3202-45c5-99b4-012917528efc/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 Na2Sn4O9 / P-3c1 (165) / materials id 762258](https://mdr.nims.go.jp/datasets/af1c3a5f-c867-4721-96cd-ff5cee523325) ## Fulltext elements: [Na, Sn, O]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: [22.99, 118.7, 16.0]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: [3.681139140259977e+00, 1.364503878447762e+02, 3.280539662124887e-01, 2.666355505554753e+01, 6.461785932508392e-01, -3.175377874048436e-01, -2.990092294836424e+04, 2.151690365872864e+06, 6.759407568591399e+03, 5.044575370259670e+06, 4.729931782414275e+04, 4.757161211433771e+06, 3.107918953155732e+04, 3.293890573701269e+01, 3.711605443104581e+02, -4.418114948842438e+02, -2.460863592955845e+06, 7.585301832075152e+03, 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