# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/2484aaf8-7017-4165-a918-7b60e45cd684/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 RbCuO2 / Cmcm (63) / materials id 7467](https://mdr.nims.go.jp/datasets/885682bd-fc38-4b4d-bd23-1058fb008f39) ## Fulltext elements: [O, Cu, Rb]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: [16.0, 63.55, 85.47]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: [-5.452672941606836e-01, 4.243580092724047e-02, 1.559272332384156e+00, -3.313481458034816e+01, 7.538864693563669e+01, 1.996451648263995e+03, 1.380154039011180e+03, 2.392495786243993e+01, 4.987527869454917e+04, 2.682467059573988e+00, -1.344251184771030e+03, 5.940064852761172e+02, 1.631453522377321e+04, -8.497753678291002e+02, 6.356394959677869e+04, 0.000000000000000e+00, -1.243834479423164e+04, -9.695926309764686e+05, 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