# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/ea9ecd75-de35-4b7f-8959-b16304898bda/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 HoAlO3 / Pnma (62) / materials id 4891](https://mdr.nims.go.jp/datasets/c490aec2-bcd3-4394-a16d-2e27d2d124ad) ## Fulltext elements: [O, Al, Ho]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, 26.98, 164.9]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: [3.032033256433288e+00, -5.838929953244711e-02, 2.929553294599571e-01, 1.321083651018057e+03, 5.069083436495667e+00, 1.493720527764155e+02, 8.567050541240332e+02, 7.147596638622979e+01, 2.902064528096878e+03, 1.509532464894960e+00, 2.158202917242271e+01, 7.716637753850526e+04, -4.468522725036612e+01, 5.593578178256821e+01, 2.577527988109915e+03, -4.276211539353678e+03, 0.000000000000000e+00, 0.000000000000000e+00, 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