# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/d0013794-1427-4aff-8cff-1836a0a0c3d5/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 Rb4SnO3 / Pbca (61) / materials id 769368](https://mdr.nims.go.jp/datasets/6eb04349-1e32-45d7-9369-34950b2a5927) ## Fulltext elements: [Rb, 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: [85.47, 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: [1.808437339419470e+02, 5.622986927062822e+02, 3.234633237473239e-01, 0.000000000000000e+00, 2.681478696614514e-03, 5.196543312223656e+00, 0.000000000000000e+00, 0.000000000000000e+00, 3.354936046539920e+06, 0.000000000000000e+00, 1.691361761163232e+07, 0.000000000000000e+00, 3.086927678273910e+05, -1.615615853592620e+04, -1.194172792410432e+03, 9.902499185016521e+04, 0.000000000000000e+00, 0.000000000000000e+00, 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