# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/26c51c53-2b55-44f0-b28f-bb5eda8060e0/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 GaN / F-43m (216) / materials id 830](https://mdr.nims.go.jp/datasets/527318d6-e8c4-4f67-bee0-2eb0f4b17d39) ## Fulltext elements: [N, Ga]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: [14.01, 69.72]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: [7.254492455616911e+00, 2.057454063416515e-01, 1.334606648012748e+01, 8.326644421874984e+04, 1.592456334337723e+03, 5.237620237640365e+00, 1.304747703299778e+03, -2.872524692448320e+04, -5.638501243902055e+04, 4.674026770617421e+01, 2.598595670762179e+01, -8.926318343495426e+02, -7.043679158401172e+04, 0.000000000000000e+00, -1.669918193089634e+03, 7.826946212628244e+00, -2.246536880985351e+03, 3.347658858022000e+05, -1.476194738914804e+05, 7.825607759505235e+02, 3.151902790110062e+00, -1.836477892771402e+02, 1.898593797060771e+05, -1.396856411115359e+05, -3.948603104708287e+03, -8.468921779217082e+00, 1.936167780084291e+02, -1.459334760364278e+05, 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