# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/121700a7-6b94-4b28-9d64-f171b5222080/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 Al2PbO4 / Ama2 (40) / materials id 21892](https://mdr.nims.go.jp/datasets/2636fb5b-702e-4f2a-b7c4-00e09a1147b5) ## Fulltext elements: [O, Al, Pb]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, 207.2]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: [1.761304037820587e+01, -1.571875058235451e-01, -6.164695485105635e-01, 2.519850100019130e+01, 1.847108685857458e+01, 1.206736262220596e+05, -1.593052217362750e+04, 4.914344566282509e+02, 1.851299938883535e+04, 3.665742663944231e+00, 6.445577401348801e+01, -1.486704640187574e+02, 2.117917925208214e+03, 3.806506115101990e+02, 2.763650248933498e+04, 0.000000000000000e+00, -1.205289431054195e+05, 6.903821118571580e+06, 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