# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/9eb988ae-798b-43bb-9f1a-d4e9ce2f6db9/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 HoNbO4 / C2/c (15) / materials id 3144](https://mdr.nims.go.jp/datasets/331b6a70-640d-46ca-96d7-2f142ec277e2) ## Fulltext elements: [O, Nb, Ho]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, 92.91, 164.9]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: [1.241627295631579e+01, 3.630022045074313e-01, -6.193817567656545e-02, 6.229115718322649e+02, 2.767013642868631e+03, 2.869778446182534e+03, -6.184655571237612e+03, 4.580008457699630e+03, 1.573155722586741e+03, 3.393699826108723e+01, 4.586437670107139e+02, -3.275439521275071e+03, 3.008081120489270e+05, 1.725487253330355e+02, 1.141265683240207e+06, 1.770921177680337e+06, 0.000000000000000e+00, 0.000000000000000e+00, 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