# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/6818e5c4-5139-4429-825f-f988eb02e1fa/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 Dy5C2Br9 / P2_1/c (14) / materials id 567407](https://mdr.nims.go.jp/datasets/a6d850eb-5498-42d0-99f1-c2af7040d01d) ## Fulltext elements: [Dy, C, Br]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: [162.5, 12.01, 79.9]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: [1.570421975798087e+02, 1.423372309048757e+00, 1.280474342897757e+01, -7.951625330754592e-04, -8.447982490462106e+02, -2.297559284242945e+03, -3.321090035711322e+07, -8.450342909410096e+05, -4.177809440325726e+06, 7.087732254165875e+02, 7.329204225920082e+03, -4.822780562587433e+01, -1.485987563912175e+06, -1.166801070029843e+03, 2.699103071814660e+07, 2.203617314040609e+07, 2.132684397494919e+00, 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