# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/bce56176-09d4-40a5-bec7-f3f66bb065f2/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 RbScO2 / R-3m (166) / materials id 8145](https://mdr.nims.go.jp/datasets/15ea9192-53a7-4066-b82a-04436aeb398c) ## Fulltext elements: [O, Sc, 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, 44.96, 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: [8.254194165309811e-01, 1.978163919062934e-02, 4.688960049673953e-01, 2.787002057248835e+01, 2.318109925276512e+02, 1.566912258343980e+01, 1.487941635750731e+03, 7.777665501770953e+01, 9.278290538476533e+03, 3.505309674659625e+00, -1.330616644413982e+02, -2.722679334020634e+02, 6.133559559623335e+03, 1.816838932597714e+03, 5.203254086869454e+05, 9.231362299808852e+03, 0.000000000000000e+00, 0.000000000000000e+00, 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