# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/252c0b96-d9c2-4068-8a5a-59768ed7d607/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 Hf3SnO8 / P2 (3) / materials id 761842](https://mdr.nims.go.jp/datasets/2a19bfec-f90f-4c1f-8a18-fe23c7375638) ## Fulltext elements: [Hf, Sn, O]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: [178.5, 118.7, 16.0]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: [9.176051194450524e+02, 7.081839163873410e+02, 4.164709261673164e+00, 0.000000000000000e+00, -2.897378172290212e-01, 7.092239199514091e+00, 0.000000000000000e+00, 0.000000000000000e+00, 4.548497937115152e+04, 0.000000000000000e+00, -3.042464448723879e+05, 0.000000000000000e+00, -2.728952174060101e+04, 8.593300294498128e+01, -8.382554643608655e+02, 4.419067496384991e+03, 0.000000000000000e+00, 0.000000000000000e+00, 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