# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/67b99576-f090-4550-940d-de594e1ec4a9/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 Ho2P4O13 / C2/c (15) / materials id 779522](https://mdr.nims.go.jp/datasets/0cb73214-f102-4c81-9b10-f30890fea1f5) ## Fulltext elements: [Ho, P, O]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: [164.9, 30.97, 16.0]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: [8.729426343423853e+03, 1.022092419748752e+01, 1.114676337643291e-01, -1.166364769306266e-01, -7.193651571299875e-02, 3.030596340670172e+00, 0.000000000000000e+00, 0.000000000000000e+00, 9.556464766182828e+04, 8.162562934230850e+05, 1.116645684759276e+04, -2.560940757851115e+06, -1.631723384550020e+02, 8.379077567202174e+01, -4.511129022027063e+01, 1.990026105666760e+03, 2.586549972651749e+05, -6.252256071740673e+01, 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