# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/f929d106-d11d-4b4d-be7b-a743e62080fb/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 Tm2O3 / Ia-3 (206) / materials id 1767](https://mdr.nims.go.jp/datasets/01a5c60b-88a2-49a1-827f-4401db0f4044) ## Fulltext elements: [O, Tm]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, 168.9]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: 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: [3.776702918297964e+00, 9.675537882616936e+00, 4.169381292327149e+02, -2.559175378730488e+04, 4.570798564289557e+03, -2.290599192913297e+02, -5.293290015944435e+04, 0.000000000000000e+00, 8.863733041115502e+04, -2.587294587074713e+04, 4.658579188689077e+03, -1.627952013071980e+05, 0.000000000000000e+00, 3.320335922580764e+05, 2.201097576141994e+04, -1.469399729369372e+02, 1.917221598509814e+05, 0.000000000000000e+00, 3.276273760853061e+05, 3.065859011474666e+04, 4.476172968797071e+00, -7.856613858807432e+05, 0.000000000000000e+00, 2.143465202079870e+04, 1.938437485643119e+03, -5.730754814863145e+01, 8.029131303063037e+05, 0.000000000000000e+00, -7.969818854517599e+03, 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