# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/6682fb48-3f05-4b3b-bd54-469f8ba65a46/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 ZnO / P6_3mc (186) / materials id 2133](https://mdr.nims.go.jp/datasets/f10b0214-bcf6-4eb9-9246-6aa0f503125b) ## Fulltext elements: [O, Zn]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: [16.0, 65.39]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: [-2.450716606036080e+02, -5.422369673463905e-01, 7.079021358175136e+01, -1.996487459427752e+06, 8.688699470006142e+03, 5.317106893734690e+01, -9.259645654841077e+03, -2.055539119269690e+04, -5.984646494911403e+05, 8.445196919714201e+04, 1.057813634551746e+02, -7.427198125095984e+04, 4.941675899570063e+06, 0.000000000000000e+00, -2.658025868106531e+04, 2.091183218644817e+01, -9.667107316333264e+03, 0.000000000000000e+00, 0.000000000000000e+00, 5.251119606102307e+04, 1.912186578449945e+01, -2.869756412472661e+04, 0.000000000000000e+00, 1.538120249367619e+06, -1.512999018357339e+04, -4.453902613055635e+01, -2.442495026659797e+04, 1.352005617942634e+07, 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