# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/10b0bdfb-f158-4df0-9fe9-150dc1862823/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 CdSnO3 / Pnma (62) / materials id 849371](https://mdr.nims.go.jp/datasets/ae091969-418f-4f8b-8135-a0ac10619490) ## Fulltext elements: [Cd, 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: [112.4, 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: [1.310877626256785e+03, 9.573703343950353e+00, 4.500157058280554e-01, 7.223617045280024e+03, 9.475186327998028e-02, 4.548010262784295e+00, 0.000000000000000e+00, 0.000000000000000e+00, -1.347974015232748e+06, -2.154925240283027e+06, 2.680548967160817e+04, 0.000000000000000e+00, -3.574751092634519e+03, 7.373981501181126e+01, -3.556421476696689e+02, -4.136296353637503e+03, 0.000000000000000e+00, -9.968948920306940e+06, 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