# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/76d0c1ff-bead-446c-9e5b-01ef16fa1e46/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 RbS / Immm (71) / materials id 558071](https://mdr.nims.go.jp/datasets/397b4d37-cd35-43cd-8d2b-9a8566fe78f4) ## Fulltext elements: [Rb, 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: [85.47, 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: [7.606397896418658e+02, 7.407437848668353e+01, 2.944825318735891e-01, 0.000000000000000e+00, 0.000000000000000e+00, -9.653888109520676e+05, -1.737754430588361e+03, 1.149732147008074e+02, 0.000000000000000e+00, 0.000000000000000e+00, -7.697917794545990e+06, -6.824324026612745e+04, 6.644196514141679e+01, 0.000000000000000e+00, 0.000000000000000e+00, 4.425101240847410e+06, 4.002508389056646e+04, 5.150843765637294e+01, 0.000000000000000e+00, 0.000000000000000e+00, -5.919332053860445e+06, 6.169654406404497e+03, 4.352910808627829e+01, 0.000000000000000e+00, 0.000000000000000e+00, -1.382577581488111e+07, 9.269857043411510e+04, -3.835538019526817e+01, 0.000000000000000e+00, 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