# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/97588f49-6a83-4ae7-8ca5-0a5619acdfff/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 YbH2 / Pnma (62) / materials id 864603](https://mdr.nims.go.jp/datasets/bff5bfed-dc91-4cc7-b370-ad468ccb7d0b) ## Fulltext elements: [Yb, H]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: [173.0, 1.008]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: [6.399842588478558e+01, 1.320360373079535e+00, 2.845768473106844e-01, 0.000000000000000e+00, -7.091392853551023e+03, 3.086053185744910e+01, 1.026738371542615e+02, -2.770179753475875e+01, 0.000000000000000e+00, -5.563538842691115e+04, 1.301383884986284e+02, -7.245408907427438e+02, 3.628727414501332e+02, 0.000000000000000e+00, 2.475085745200827e+04, -9.155891419719897e+01, -4.807760541092474e+02, 7.719892468295018e+01, 0.000000000000000e+00, 6.417410798925038e+04, 7.527979235197067e+01, 1.568560682892591e+02, 6.307683201223848e+01, 0.000000000000000e+00, -7.258659068106663e+04, -1.669704560519132e+01, 3.509589202115300e+02, -2.758020621842974e+02, 0.000000000000000e+00, 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