# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/d2af1006-fccd-4d6d-9abb-44a52e80fc5d/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 Ho2Te4O11 / C2/c (15) / materials id 542514](https://mdr.nims.go.jp/datasets/c1852fd0-a149-430e-9159-d55dfc80474c) ## Fulltext elements: [Ho, Te, 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, 127.6, 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: [-9.495160774931162e+01, 3.130488358125715e+03, 4.915011823419719e+00, -1.375426484673160e+03, -3.259904910216755e-01, 3.768183324627645e+01, 0.000000000000000e+00, 0.000000000000000e+00, -9.742632650857363e+05, 0.000000000000000e+00, 7.423193911132206e+05, 0.000000000000000e+00, 1.816072574220552e+04, -2.874683879675940e+02, -1.363642815971622e+03, 3.789984127391915e+04, 0.000000000000000e+00, 1.826627311314648e+05, 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