# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/896f771a-0a3e-494c-ad3a-ea0f4eee7a2b/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 Sr(RhO2)2 / Pmmn (59) / materials id 766173](https://mdr.nims.go.jp/datasets/38ba29fb-cfc9-46e9-a198-47b2b4279c3b) ## Fulltext elements: [Sr, Rh, 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, 102.9, 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: [2.101823028991949e+03, 1.484265600716675e+01, 7.056475133639576e-01, -5.347742844197681e+01, -1.171911274250834e-01, -1.363072728274586e+00, 0.000000000000000e+00, 0.000000000000000e+00, -5.717236452916003e+05, -8.274604426481888e+04, -2.094033644872934e+03, -2.006986718995232e+05, -3.844216034433133e+03, 1.252551929823693e+03, -1.526186336811090e+03, 1.154394524385428e+04, 7.127708088506882e+05, 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