# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/e654d069-2294-42ff-ba11-68e294827602/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 U(OF)2 / R-3m (166) / materials id 27980](https://mdr.nims.go.jp/datasets/6b806564-b6f7-420d-9015-313cafef36d4) ## Fulltext elements: [U, O, F]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: [238.0, 16.0, 19.0]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: [3.967383427433656e+04, 1.316343312907146e-01, -5.313870596867235e-01, 3.052015436500021e+00, 2.475109533266225e-01, 2.248969170548658e+00, 0.000000000000000e+00, 1.846488384087603e+06, 0.000000000000000e+00, 8.659681194852167e+00, 4.019254049169615e+00, 1.830928420007239e+02, 9.777436860709606e+01, -1.930294874988348e+02, -2.216882342321912e+02, 6.019031362106530e+02, -2.181372318251574e+04, -4.067174764172962e+04, 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