# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/daea60cc-eda8-4cf7-9a27-e28c1eb81de2/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 YSnF7 / P2_1/c (14) / materials id 18183](https://mdr.nims.go.jp/datasets/82a8bab7-100d-4eef-9302-85af31194944) ## Fulltext elements: [F, Y, Sn]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, 88.91, 118.7]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: [6.496093332339095e+00, 4.687189790435860e-01, 5.986044486846849e-01, -1.079438958093365e+05, 3.144200002206934e+04, 0.000000000000000e+00, -6.530558251169397e+03, 4.895304746341882e+03, 1.428775921607931e+03, 1.318522514345850e+02, -3.671477703880020e+02, 0.000000000000000e+00, -2.422113463034590e+07, 6.219719036824455e+00, -1.893188540814649e+07, 0.000000000000000e+00, 0.000000000000000e+00, 0.000000000000000e+00, 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