{ "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" [ [ 0.9163946 0.5446671 1.49786 ] [ 0.0084298 2.294234 2.779305 ] [ 1.912564 0.4098673 0.1717336 ] [ 2.851379 0.2549877 2.412214 ] [ 1.718971 2.318251 1.204915 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.163945999999999e-11 5.446671e-11 1.49786e-10 ] [ 8.4298e-13 2.294234e-10 2.779305e-10 ] [ 1.912564e-10 4.098673e-11 1.717336e-11 ] [ 2.851379e-10 2.549877e-11 2.412214e-10 ] [ 1.718971e-10 2.318251e-10 1.204915e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -42.067294 -17.9247202 39.4541336 ] [ -4.7380708 3.5844853 5.1982901 ] [ 28.8759197 -16.4622059 -55.6068996 ] [ 9.1198928 -3.768063 11.2285961 ] [ 8.8095524 34.5705038 -0.2741203 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.739923550240838e-08 -2.87185678754278e-08 6.32124909686343e-08 ] [ -7.591226325997687e-09 5.74297859257648e-09 8.328578934973523e-09 ] [ 4.626432382860028e-08 -2.637536163707694e-08 -8.909207522830392e-08 ] [ 1.461167914874483e-08 -6.037102494039942e-09 1.799019430404353e-08 ] [ 1.411445901127862e-08 5.53880534139682e-08 -4.391891395650701e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 17.170066 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.750947854943784e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8071097 0.1378735 1.8166265 ] [ -0.2330465 2.466863 2.5011407 ] [ 1.5205017 0.6871298 -0.6661271 ] [ 3.1571859 0.3392121 3.0046 ] [ 2.1559875 2.1909288 1.4097875 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.071097e-11 1.378735e-11 1.8166265e-10 ] [ -2.330465e-11 2.466863e-10 2.5011407e-10 ] [ 1.5205017e-10 6.871298e-11 -6.661271e-11 ] [ 3.1571859e-10 3.392121e-11 3.0046e-10 ] [ 2.1559875e-10 2.1909288e-10 1.4097875e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.4e-06 2.05e-05 -8.2e-06 ] [ 7.1e-06 -3.2e-06 1.12e-05 ] [ 7.2e-06 -5.2e-06 0.0 ] [ -1.04e-05 7.7e-06 -4.3e-06 ] [ -1.34e-05 -1.98e-05 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.50604603596e-14 3.2844620997e-14 -1.31378483988e-14 ] [ 1.13754541014e-14 -5.1269652288e-15 1.79443783008e-14 ] [ 1.15356717648e-14 -8.331318496799998e-15 0.0 ] [ -1.66626369936e-14 1.23367600818e-14 -6.8893595262e-15 ] [ -2.14691668956e-14 -3.17230973532e-14 2.0828296242e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.793383 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.049725931241282e-18 } }