# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/f38ed46d-4a93-46a2-bcf5-f02d891476ca/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 Al2Ge2O7 / C2/c (15) / materials id 9751](https://mdr.nims.go.jp/datasets/f200e10e-7814-4b77-ad70-45516d71a496) ## Fulltext elements: [O, Al, Ge]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: [16.0, 26.98, 72.61]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: [1.906427395577357e+00, -3.851381939096515e-02, 1.460057817751136e-02, 1.405902029970345e+01, 1.307177055513154e+02, 6.004426820276862e+01, -8.488223698963148e+01, 1.461285435340574e+02, 9.241735038483679e+02, 9.183524422828317e+00, -8.170405991711240e+00, 6.393946615985428e+02, 1.366473779787221e+04, 6.669402631970710e+00, 2.153233802074809e+04, 1.993716709792856e+03, 1.650880256041062e+04, -2.888784089873496e+06, 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