# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/4b7bb8f0-e855-474b-966a-44686a9118ba/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 ZnPtF6 / R-3 (148) / materials id 8256](https://mdr.nims.go.jp/datasets/161d09f3-466b-4344-a7cc-3a0703a0eecf) ## Fulltext elements: [F, Zn, Pt]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: [19.0, 65.39, 195.1]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: [1.349236415511275e+00, 2.238838255323106e-02, 1.139304000762906e-01, 0.000000000000000e+00, -7.020806383777667e+02, 0.000000000000000e+00, 2.931341855397659e+03, -2.131229519566911e+02, 1.334081178659704e+02, 4.436441646401707e+00, 2.671468481885063e+00, 0.000000000000000e+00, 5.010876472948143e+04, 3.922783445489733e+00, 1.105475951311104e+03, 0.000000000000000e+00, 0.000000000000000e+00, 0.000000000000000e+00, 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