# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/c04e3d1f-d6a7-4177-8575-dde37284976e/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 Na3AgO2 / Ibam (72) / materials id 3527](https://mdr.nims.go.jp/datasets/10a98c33-abee-4a6f-a5e3-011f680afc63) ## Fulltext elements: [O, Na, Ag]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, 22.99, 107.9]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: [1.101322271845845e+02, 4.618246220825616e-02, 6.631835495498599e-02, 1.967225309864485e+00, 1.531628553419146e+00, -5.663624662959237e+00, 0.000000000000000e+00, -6.859488061888780e+03, 5.756562492857563e+05, 1.899846309028355e+01, -3.412313737167086e+01, -6.263298354503226e+01, -4.037590437886960e+02, 1.768841946101002e+01, 2.562835321612144e+01, 8.589306108029207e+02, 1.252237537548423e+03, 7.648793362905053e+02, 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