# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/7042d065-e824-4dcc-a282-255d0801147a/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 Ag3SbS3 / P2_1/c (14) / materials id 555269](https://mdr.nims.go.jp/datasets/09850bb7-e9d4-4a73-96a5-0d38128503bf) ## Fulltext elements: [Ag, Sb, S]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: [107.9, 121.8, 32.07]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: [8.663517295324773e+00, -1.293612988788697e+03, -1.289712421174833e-01, 2.257386572239930e+02, 3.327623027926755e-01, 1.061772027372851e+02, 1.270333081284830e+05, 0.000000000000000e+00, -4.689347725893294e+03, 0.000000000000000e+00, 7.077455635281373e+05, 0.000000000000000e+00, -1.781327038533640e+06, 4.430296169047002e+01, -2.515148949173297e+03, 3.421323289868936e+05, 0.000000000000000e+00, 2.839809386827072e+06, 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