# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/41d537d9-406c-42e1-b649-8b32f8966bab/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 CsBiO2 / C2/c (15) / materials id 29506](https://mdr.nims.go.jp/datasets/6ecceba2-8ee1-4728-abf8-9cab74dc8939) ## Fulltext elements: [O, Cs, Bi]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, 132.9, 209.0]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: [2.585232321882776e+00, 1.586588645184526e+00, 2.001735185994946e-01, -1.491703200443273e+03, 1.744132871943752e+03, 2.370065361862558e+01, 1.944212154814028e+04, 1.377908292788689e+05, -2.750849315343234e+02, 8.614294213607898e+03, -5.136522823212007e+03, 0.000000000000000e+00, 0.000000000000000e+00, 4.722708386682167e+01, 3.185502699375741e+06, 1.232495107479054e+04, 0.000000000000000e+00, 0.000000000000000e+00, 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