# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/30bfa979-b985-408b-b95c-5bb681eaaa63/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 KSbO2 / C2/c (15) / materials id 10417](https://mdr.nims.go.jp/datasets/8a4dddfa-ba4c-4943-a08f-7379e6cc47e7) ## Fulltext elements: [O, K, Sb]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: [16.0, 39.1, 121.8]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: [4.223547542503475e+00, 2.181096557510455e+00, -2.471026672361460e-01, 2.025133870786207e+02, 5.992133595647841e+02, 3.486629153461261e+01, 3.571053633623590e+03, 5.341110527979289e+04, 2.142893436800642e+03, 2.305016454503098e+04, -1.341349376592193e+03, 3.545559607450043e+06, 9.866271186683051e+06, 6.117739173321474e+00, 5.163380865052697e+05, -8.373560894271623e+03, 0.000000000000000e+00, 0.000000000000000e+00, 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