{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.38521 1.90546 0.8111876 ] [ 1.820048 1.934055 3.373724 ] [ 3.762919 1.896883 2.504871 ] [ 3.3319 2.668439 4.803022 ] [ 3.103403 4.016922 2.717172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.38521e-10 1.90546e-10 8.111876000000001e-11 ] [ 1.820048e-10 1.934055e-10 3.373724e-10 ] [ 3.762919e-10 1.896883e-10 2.504871e-10 ] [ 3.3319e-10 2.668439e-10 4.803022000000001e-10 ] [ 3.103403e-10 4.016922e-10 2.717172e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2776382 -0.8908464 -3.9065975 ] [ -10.2471328 -2.7273011 1.2721342 ] [ 9.9688875 -4.3029897 -2.4564162 ] [ 2.5410346 1.267344 5.4448599 ] [ 0.0148488 6.6537932 -0.3539804 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.649178704745819e-09 -1.427293286563017e-09 -6.259059232942814e-09 ] [ -1.641771673765499e-08 -4.369618096302497e-09 2.038183690552283e-09 ] [ 1.597191861947467e-08 -6.894149553682669e-09 -3.93561263901907e-09 ] [ 4.071186262305536e-09 2.030508944040096e-09 8.723627307183575e-09 ] [ 2.37904004029392e-11 1.066055199250809e-08 -5.671391257739735e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.9257894 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.49416131468488e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3352976 1.1933298 1.2159352 ] [ 1.3627364 2.4390211 3.0212983 ] [ 4.25785 2.1963789 2.2428928 ] [ 3.3468516 2.2618709 4.6451153 ] [ 3.1007443 4.3311583 3.0847351 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3352976e-10 1.1933298e-10 1.2159352e-10 ] [ 1.3627364e-10 2.4390211e-10 3.0212983e-10 ] [ 4.25785e-10 2.1963789e-10 2.2428928e-10 ] [ 3.3468516e-10 2.2618709e-10 4.6451153e-10 ] [ 3.1007443e-10 4.3311583e-10 3.0847351e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.4e-06 -4.3e-06 -4.2e-06 ] [ -2.2e-06 2.5e-06 1.5e-06 ] [ 4.7e-06 1e-07 2.2e-06 ] [ 2.3e-06 -8.6e-06 5.4e-06 ] [ -2.4e-06 1.03e-05 -5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.845223921599999e-15 -6.8893595262e-15 -6.729141862799999e-15 ] [ -3.5247885948e-15 4.005441585e-15 2.403264951e-15 ] [ 7.530230179799999e-15 1.602176634e-16 3.5247885948e-15 ] [ 3.685006258199999e-15 -1.37787190524e-14 8.6517538236e-15 ] [ -3.845223921599999e-15 1.65024193302e-14 -8.010883169999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.750145 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.722363113111193e-18 } }