# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/d4a0cef8-f201-431c-990b-43f3db3cd836/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 Li5GeP3 / Cc (9) / materials id 674531](https://mdr.nims.go.jp/datasets/53a81569-8cbc-46de-91ab-e4705e7ee40d) ## Fulltext elements: [Li, Ge, P]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: [6.941, 72.61, 30.97]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: [1.409179133982866e+01, 4.140879441469845e+00, 1.526998996414055e+00, 0.000000000000000e+00, 3.802595688978723e-02, 3.367398463868695e+03, -7.770455450899074e+03, -2.216440508753222e+04, -7.220097509845384e+02, 1.243143820522490e+04, -2.944761364158315e+02, 0.000000000000000e+00, 4.147950361203326e+02, 4.590567283710261e+02, -1.376536257291220e+03, 1.152085008353758e+07, 0.000000000000000e+00, 0.000000000000000e+00, 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