# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/ae632374-1742-4df8-b2c2-69528421405b/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 Sr7GeN6 / Pbcn (60) / materials id 568436](https://mdr.nims.go.jp/datasets/d4724b48-a5ab-4c2a-ad84-24ae322fa29b) ## Fulltext elements: [Sr, Ge, N]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, 72.61, 14.01]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: [2.390992382111910e+02, 5.310930365540263e+01, 5.108981343820732e-01, 0.000000000000000e+00, -8.458802172267085e-02, 1.202159440563275e+00, -1.689044107477689e+07, 0.000000000000000e+00, -2.229356850548444e+05, 1.641845427908941e+03, 1.210928437975272e+05, 0.000000000000000e+00, -2.520186199050372e+03, -1.923164348427810e+03, -4.509981862733038e+03, 1.829835378497476e+05, 0.000000000000000e+00, 0.000000000000000e+00, 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