# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/f884952b-0d3c-4898-8881-6bc0ac791216/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 K2Sn2S5 / C2/c (15) / materials id 8965](https://mdr.nims.go.jp/datasets/49d2f6c2-53a9-4233-9d6a-e274ba5af669) ## Fulltext elements: [S, K, Sn]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: [32.07, 39.1, 118.7]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: [-1.334393628473817e+01, 4.951018829336277e+01, -7.703311458090376e-01, 1.073263455893357e+04, 5.820903452787496e+01, -4.499016363565134e+02, 4.416418525054064e+07, -3.883721689177752e+06, -7.682971811375855e+05, -1.088537059983008e+06, -2.806011445409118e+04, 0.000000000000000e+00, 0.000000000000000e+00, 4.569367206048004e+02, -1.534886847228354e+07, -5.862600054281736e+05, 0.000000000000000e+00, 0.000000000000000e+00, 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