# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/f37ce67e-89a6-4975-a918-6d7028d71578/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 Cs4Zn3F10 / Cmce (64) / materials id 17951](https://mdr.nims.go.jp/datasets/631fd7dd-85d6-46c8-a1fd-745c1cb6b5cd) ## Fulltext elements: [F, Zn, Cs]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: [19.0, 65.39, 132.9]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: [1.003639646001580e+00, 4.245522129253148e-02, 3.426554480055862e+00, 1.816690735243837e+00, 5.395237936061055e+01, 6.263682580125597e+03, 7.444904874233051e+02, -3.453928592226274e+01, 4.374092585798770e+03, 6.290395120611734e+00, 1.293026601150648e+03, 4.374183552681881e+00, -1.113868744580679e+04, 2.165176106688580e+04, 0.000000000000000e+00, 0.000000000000000e+00, 8.351477650355419e+03, 0.000000000000000e+00, 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