{ "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" [ [ 0.3288529 1.174724 0.8712814 ] [ 1.395659 1.176494 2.521247 ] [ 2.395391 0.4245255 0.3168768 ] [ 2.017962 2.536207 0.5333854 ] [ 2.744316 1.992854 1.84914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.288529e-11 1.174724e-10 8.712814e-11 ] [ 1.395659e-10 1.176494e-10 2.521247e-10 ] [ 2.395391e-10 4.245255e-11 3.168768e-11 ] [ 2.017962e-10 2.536207e-10 5.333854e-11 ] [ 2.744316e-10 1.992854e-10 1.84914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.1117328 -3.6353311 -6.8754161 ] [ -8.6422011 -7.8001649 22.3242332 ] [ 8.5740373 -16.6224443 -12.0216611 ] [ -1.3601478 20.5951914 -17.6133208 ] [ 22.5400445 7.4627489 14.1861648 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.382472471673652e-08 -5.824442497287147e-09 -1.101563093369191e-08 ] [ -1.384633255467204e-08 -1.249724184116477e-08 3.576736451032717e-08 ] [ 1.373712210792716e-08 -2.663209163801022e-08 -1.926082435760081e-08 ] [ -2.179197005992555e-09 3.299713416198122e-08 -2.821965080041035e-08 ] [ 3.611313232969163e-08 1.195664181448092e-08 2.272874158137591e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 74.66743 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.196304106812205e-17 } "relaxed-configuration-positions" { "source-value" [ [ -2.0035045 0.76829 -0.059037 ] [ 0.5685229 0.3289426 4.7826207 ] [ 3.2256386 -1.0522147 -0.6235363 ] [ 1.9084499 4.5106244 -1.0304946 ] [ 5.183074 2.7491621 3.0223778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.0035045e-10 7.682900000000001e-11 -5.9037e-12 ] [ 5.685229000000001e-11 3.289426e-11 4.7826207e-10 ] [ 3.2256386e-10 -1.0522147e-10 -6.235363000000001e-11 ] [ 1.9084499e-10 4.510624400000001e-10 -1.0304946e-10 ] [ 5.183074e-10 2.7491621e-10 3.0223778e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 0.0 -0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }