# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/7817e726-cb7f-4088-a546-9a5aa9af5fbf/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 Na2S5 / Pnma (62) / materials id 28127](https://mdr.nims.go.jp/datasets/b41ae9d2-ca0a-4c31-a7cb-106bf1153722) ## Fulltext elements: [Na, 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: [22.99, 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: 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: [-2.188813878864038e+04, -5.579414240844814e+01, 1.188419216205015e+00, 0.000000000000000e+00, 0.000000000000000e+00, 1.638691706262223e+05, 2.573804893331719e+04, 1.416754833782226e+02, 0.000000000000000e+00, 0.000000000000000e+00, 1.549445427691157e+06, -7.876390189124490e+03, 4.252116750745392e+02, 0.000000000000000e+00, 0.000000000000000e+00, -4.263008448464328e+05, -5.183357463050518e+03, -5.949371568320913e+02, 0.000000000000000e+00, 0.000000000000000e+00, -6.529650086111577e+04, 5.599403198908731e+04, -1.458835715941575e+02, 0.000000000000000e+00, 0.000000000000000e+00, 8.182160402096329e+05, 1.561616926477855e+05, -2.598049354489236e+02, 0.000000000000000e+00, 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