# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/90db3160-c3b3-4794-a2f0-47b7454d551d/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 Ag3P11 / Cm (8) / materials id 27821](https://mdr.nims.go.jp/datasets/dfbe2c33-7e37-42ef-8870-d32f5e1dade7) ## Fulltext elements: [P, Ag]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: [30.97, 107.9]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: 3type_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: [1, 1] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]type_full: 1type_indices: [0, 1]n_coeffs: 8283coeffs: [4.045256857775255e+00, -2.762393786000179e+01, 1.507983006137481e+04, -2.693555738472157e+02, -2.171085764121267e+04, 6.371534217707830e+03, -8.436047515453409e+07, 0.000000000000000e+00, -3.911856311559813e+03, -1.294883992511666e+04, -3.489979412047342e+04, 2.366659197232599e+07, 0.000000000000000e+00, 1.012404029798769e+04, 2.763526504446093e+04, 3.468623711255951e+04, 0.000000000000000e+00, 0.000000000000000e+00, 9.870964923444657e+02, 6.724891667557169e+03, -1.548081408501779e+04, 8.818157440044576e+07, 0.000000000000000e+00, 7.550818610532331e+02, -1.013822863387425e+03, -1.394473947592242e+04, -2.596352482485121e+08, 0.000000000000000e+00, 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