# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/fffff714-d62a-40cb-b068-97b3c965036f/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 CdIn2O4 / Fd-3m (227) / materials id 19803](https://mdr.nims.go.jp/datasets/82861649-eb48-47bc-b921-5070fc850380) ## Fulltext elements: [O, Cd, In]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, 112.4, 114.8]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: [7.443884918539616e-01, 6.340070569606920e-02, 3.321622897375452e-02, 1.686056612094162e+03, 3.497320790721931e+02, 1.667132638012598e+01, 1.548489681378149e+03, -8.324719043617161e+01, 6.267686428286184e+01, 1.427937722135525e+01, -9.721762659741559e+00, 0.000000000000000e+00, 3.587880035092805e+04, 3.527731648129039e+00, -5.549434862799180e+03, -2.553907745211066e+02, 0.000000000000000e+00, 0.000000000000000e+00, 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