# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/aa716cdf-c65d-4504-acac-96addc720e3e/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 HoGaO3 / Pnma (62) / materials id 755416](https://mdr.nims.go.jp/datasets/6585cfe7-a135-41a9-bf53-865541789cd3) ## Fulltext elements: [Ho, Ga, 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: [164.9, 69.72, 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: [3.371703701053158e+02, 1.675191135531898e+01, 1.652498830678742e-01, 3.327127851209632e+03, -2.730316142598807e-01, 7.989317559631605e+00, 0.000000000000000e+00, 0.000000000000000e+00, -3.391652486952530e+05, 1.587348379339479e+05, 1.477320109801687e+04, 0.000000000000000e+00, -2.478391047716313e+03, 5.982494348099134e+01, -1.357852229395423e+02, 1.341457177682605e+04, 0.000000000000000e+00, 5.689426249262852e+05, 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