# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/4c07185c-d571-4387-b3fd-0915191cba5f/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 Sr2Bi2O5 / Pnma (62) / materials id 23357](https://mdr.nims.go.jp/datasets/833b6779-bc7e-40e9-97b2-920e7dec36e2) ## Fulltext elements: [Sr, Bi, 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: [87.62, 209.0, 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: [1.018446448268863e+04, 3.319335499888252e+02, -4.534396523366636e-02, 2.173711594694505e+02, 4.119802625840410e-01, 2.966769042733054e+01, 0.000000000000000e+00, 0.000000000000000e+00, 9.302093034621822e+06, 0.000000000000000e+00, 1.860357094932342e+06, 0.000000000000000e+00, -3.372539002437192e+05, -7.216053110015920e+02, -1.391665141528572e+03, 7.478463262811350e+03, 0.000000000000000e+00, 3.056793419441478e+05, 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