# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/48121f50-765e-4f69-b772-030ca2a6f1c8/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 SrF2 / Fm-3m (225) / materials id 981](https://mdr.nims.go.jp/datasets/272fe256-b849-47c4-9144-40b4c7f6b9d4) ## Fulltext elements: [F, Sr]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, 87.62]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: 3type_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: [1, 1] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]type_full: 1type_indices: [0, 1]n_coeffs: 8283coeffs: [3.497376587205959e+00, 7.450513574584532e-01, 1.471845298228879e+03, -6.676586474992098e+03, 1.036798639339815e+03, 1.351601797980856e+02, 0.000000000000000e+00, 0.000000000000000e+00, 1.187143068557650e+04, -3.839868768588668e+03, 4.715066971304111e+02, 0.000000000000000e+00, 0.000000000000000e+00, 9.532046484156261e+03, -5.347031741785181e+03, 2.104042614144861e+02, 0.000000000000000e+00, 0.000000000000000e+00, 2.883926609891979e+03, 2.810540292416856e+03, 2.470361960845669e+02, 0.000000000000000e+00, 0.000000000000000e+00, 2.659311639442072e+03, 1.077870470979542e+03, -2.156721911814128e+02, 0.000000000000000e+00, 0.000000000000000e+00, -5.848743413663015e+03, 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