# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/fc172284-4b73-4468-9109-a808638fcd65/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 SrNb2O4 / Pbcm (57) / materials id 768342](https://mdr.nims.go.jp/datasets/fc102052-7387-4c33-a77c-5a0d00d41c3e) ## Fulltext elements: [Sr, Nb, O]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: [87.62, 92.91, 16.0]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: [7.625650976812071e+02, 5.063420973237387e+01, 2.121368490567526e-01, 1.003669128642748e+01, 4.492675714032570e-02, 4.482990097085514e+00, 0.000000000000000e+00, 0.000000000000000e+00, 7.509862811603745e+05, 0.000000000000000e+00, 6.623748671558406e+04, -8.936450352421354e+05, -5.923410541122843e+02, 1.427578160548370e+02, -1.029132768978134e+03, 1.864833034564595e+04, 1.767180196910535e+05, 2.402460675570217e+03, 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