# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/255f84e0-00db-4d3b-9bb6-0bfcb3559d02/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 Mg3Sn / Pm-3m (221) / materials id 978294](https://mdr.nims.go.jp/datasets/a70463b4-1b6c-49b9-8d69-ffb8061735d8) ## Fulltext elements: [Mg, Sn]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: [24.31, 118.7]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: [-5.216159812331065e+01, -2.342665539285803e+01, 3.881870572885579e+05, -8.764359958091114e+05, 5.355402157376728e+06, -3.437445734119005e+05, 0.000000000000000e+00, 0.000000000000000e+00, -4.757105740839760e+06, 4.071243343949068e+06, 2.437643449873130e+06, 0.000000000000000e+00, 0.000000000000000e+00, -2.697200655617547e+05, 0.000000000000000e+00, -3.696468275385069e+06, 0.000000000000000e+00, 0.000000000000000e+00, 1.513908191479546e+07, 1.678146131111168e+05, 9.183251144035351e+06, 0.000000000000000e+00, 0.000000000000000e+00, 1.134048611739801e+06, 3.896863404860862e+06, 5.997168128270204e+06, 0.000000000000000e+00, 0.000000000000000e+00, 2.596739261717471e+06, 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