# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/dbeadcee-324f-4c65-aedb-0f38901620ae/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 SrCN2 / Pnma (62) / materials id 9167](https://mdr.nims.go.jp/datasets/a53f2c7f-7ba1-4ec1-80cc-7b0ebd0bc05a) ## Fulltext elements: [C, N, Sr]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: [12.01, 14.01, 87.62]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: [-7.482242535408040e+03, -4.082242842900486e-01, -1.253785607254268e+01, -1.888848620621371e+00, -4.990531386431939e-01, 2.081416414521390e+04, 0.000000000000000e+00, 1.944327750375035e+04, 0.000000000000000e+00, -2.817220977557040e+00, 5.600743014086153e+02, -5.971309824841028e+01, 6.521309050389948e+02, 1.428663928073006e+06, -4.336221614892148e+04, 0.000000000000000e+00, 2.810227951091104e+03, 4.112905940448354e+04, 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