{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2279875 0.3441096 1.620821 ] [ 0.0638848 2.12081 2.259282 ] [ 2.131638 0.0282353 0.491309 ] [ 2.985428 0.1085719 2.760683 ] [ 1.598201 2.879516 0.4111126 ] [ 2.843247 2.032667 1.905289 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.279875e-11 3.441096000000001e-11 1.620821e-10 ] [ 6.388480000000001e-12 2.12081e-10 2.259282e-10 ] [ 2.131638e-10 2.82353e-12 4.91309e-11 ] [ 2.985428e-10 1.085719e-11 2.760683e-10 ] [ 1.598201e-10 2.879516e-10 4.111126e-11 ] [ 2.843247e-10 2.032667e-10 1.905289e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2000646 -6.4432314 -0.7970026 ] [ -1.9199636 4.7953647 2.0357045 ] [ 1.0007008 -2.6089259 -2.5439406 ] [ 1.3610324 -2.0690885 1.718363 ] [ -0.4347286 2.5339945 -1.9540816 ] [ 4.1930236 3.7918866 1.5409573 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.729245307969704e-09 -1.032319471148445e-08 -1.276938932436814e-09 ] [ -3.076120792707003e-09 7.683021210549607e-09 3.261558156757353e-09 ] [ 1.603299426175857e-09 -4.179960082379598e-09 -4.075842154023925e-09 ] [ 2.180614291431314e-09 -3.315045221066141e-09 2.753121024647751e-09 ] [ -6.965119993131149e-10 4.059906745135786e-09 -3.130783854655457e-09 ] [ 6.717964382382651e-09 6.075272059244802e-09 2.468885759711092e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.332391 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.975866853876433e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.2776076 -0.0529497 1.7251342 ] [ -0.3712378 2.3978547 1.7890049 ] [ 1.8372437 0.0404561 0.5871009 ] [ 3.506646 0.076232 2.3157596 ] [ 1.7423163 2.5252781 0.6518678 ] [ 3.4130257 2.5270387 2.3796293 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.776076e-11 -5.294970000000001e-12 1.7251342e-10 ] [ -3.712378e-11 2.3978547e-10 1.7890049e-10 ] [ 1.8372437e-10 4.045610000000001e-12 5.871009000000001e-11 ] [ 3.506646e-10 7.6232e-12 2.3157596e-10 ] [ 1.7423163e-10 2.5252781e-10 6.518678e-11 ] [ 3.4130257e-10 2.5270387e-10 2.3796293e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 6.7e-06 -1.17e-05 ] [ -1.7e-06 -2.2e-06 5e-07 ] [ 1.05e-05 -5.5e-06 4.74e-05 ] [ 1.71e-05 1.46e-05 -1.23e-05 ] [ 9e-06 3.66e-05 -1e-07 ] [ -3.47e-05 -5.02e-05 -2.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 1.073458335936e-14 -1.874546646336e-14 ] [ -2.72370025536e-15 -3.52478856576e-15 8.010883104e-16 ] [ 1.68228545184e-14 -8.8119714144e-15 7.594317182591999e-14 ] [ 2.739722021568e-14 2.339177866368e-14 -1.970677243584e-14 ] [ 1.44195895872e-14 5.863966432128e-14 -1.6021766208e-16 ] [ -5.559552874176001e-14 -8.042926636416e-14 -3.797158591296e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.235572 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.76144305045151e-18 } }