# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/158a063f-e22e-4be8-be2f-0675a6cf0777/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 USeO5 / P2_1/m (11) / materials id 27723](https://mdr.nims.go.jp/datasets/8d000448-889c-411b-bf7d-1e163f82a19b) ## Fulltext elements: [O, Se, U]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, 78.96, 238.0]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: [1.607047842300409e+00, -2.448004639600548e-01, 5.271589453922874e-01, 2.489183562041615e+04, -6.943883401493483e+01, 6.583707595729850e+05, -8.960819097587639e+02, 1.022540811000765e+03, 3.503903311729685e+03, 1.257943597579246e+01, 2.317409457177129e+02, 0.000000000000000e+00, 9.104551922897997e+03, 2.202824973937746e+01, 2.419644853159121e+05, 0.000000000000000e+00, 0.000000000000000e+00, 0.000000000000000e+00, 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