# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/69626d97-130e-4b49-b640-27d8cd6213bd/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 LaGaO3 / Pnma (62) / materials id 5837](https://mdr.nims.go.jp/datasets/9d63d89d-f410-4528-9a1a-bcba74a72ae6) ## Fulltext elements: [O, Ga, La]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, 69.72, 138.9]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: [8.205953109862770e+00, -3.173753063052078e-01, 2.802346039971521e-01, -7.172324164627367e+03, -3.189419139144040e+00, -1.250813130666904e+03, -5.407507122682674e+03, 2.279095973717521e+02, 2.058213743002020e+04, 5.085053337622712e+00, 2.557591579532905e+01, -7.430890337809967e+05, -2.072846237525382e+02, -2.280991911482059e+02, 3.810278827874798e+04, 5.921028786914165e+06, 0.000000000000000e+00, 0.000000000000000e+00, 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