# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/f7fb29e6-d53b-43eb-944b-d02c5ca99881/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 As2Ru / Pnnm (58) / materials id 766](https://mdr.nims.go.jp/datasets/9d5dd995-a027-4ef5-87c1-81c789ead92d) ## Fulltext elements: [As, Ru]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: [74.92, 101.1]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: [-2.207207557635917e+00, 1.853312135867046e+00, 1.112697850734324e+02, 6.368694690028272e+03, 1.529640405335367e+03, 1.048411728937646e+03, -2.556118838256279e+05, -1.224862253951936e+06, -1.235520987366967e+02, -3.118786728627954e+02, 1.131345599298533e+04, -2.231439977253174e+05, 5.454857524462814e+05, -2.592645648191174e+03, 2.825163727678993e+03, 5.782058059551416e+02, 7.638913758309197e+04, -3.758291463214667e+05, -1.240905184973248e+03, -1.126517434302414e+03, -7.976505412724838e+03, -5.100184595659685e+05, 3.957416429719779e+04, -2.200760844004188e+02, 1.009145080716632e+04, -1.294119006119628e+03, 1.631528212148616e+03, 3.960938867420945e+03, 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