# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/e47bd5db-e03d-40d8-b8ba-c7789711d502/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 SrGe2 / Pnma (62) / materials id 1244](https://mdr.nims.go.jp/datasets/48dc3b28-decb-4886-afdb-5815354cb585) ## Fulltext elements: [Ge, Sr]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: [72.61, 87.62]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: [4.280737215461016e+00, 1.907630637517839e+02, -9.097429578805014e+01, 1.216437275672045e+03, 1.900145842140087e+05, -1.255645823408929e+06, 0.000000000000000e+00, 0.000000000000000e+00, 2.342984472492995e+02, -4.997157378890929e+05, -1.446855789716271e+07, 0.000000000000000e+00, 0.000000000000000e+00, -4.074905753856007e+03, 4.387586166466792e+05, 1.872449818162553e+07, 0.000000000000000e+00, 0.000000000000000e+00, -1.159586619833000e+04, 1.698295701337815e+04, 2.220332104918577e+06, 0.000000000000000e+00, 0.000000000000000e+00, -7.862204281267617e+03, 4.136202228935112e+05, -5.959885081141195e+06, 0.000000000000000e+00, 0.000000000000000e+00, -4.288660391466530e+02, 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