{ "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" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4341835 -3.9324103 -0.8432679 ] [ -5.1674135 1.0954309 3.7238799 ] [ 1.7461253 5.0975559 1.7445381 ] [ 0.4617621 3.6471611 -8.8967554 ] [ 7.3937096 -5.9077377 4.2716052 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.104345136037117e-09 -6.300415846053115e-09 -1.351064114451112e-09 ] [ -8.2791090997063e-09 1.755073777681903e-09 5.966313314447043e-09 ] [ 2.797601132647386e-09 8.167184886201103e-09 2.795058157914853e-09 ] [ 7.398244409915117e-10 5.843396246711211e-09 -1.425417350285615e-08 ] [ 1.184602866210452e-08 -9.465239224758764e-09 6.843865984727708e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.5476168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.049043855891731e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6007064 2.5801649 1.4422243 ] [ 1.9704277 4.3885829 3.0444164 ] [ 4.2362137 5.2515868 2.4476708 ] [ 3.4943926 4.5361643 0.1733496 ] [ 4.7905646 2.822869 2.6170751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6007064e-10 2.5801649e-10 1.4422243e-10 ] [ 1.9704277e-10 4.388582900000001e-10 3.0444164e-10 ] [ 4.2362137e-10 5.2515868e-10 2.4476708e-10 ] [ 3.4943926e-10 4.536164300000001e-10 1.733496e-11 ] [ 4.790564599999999e-10 2.822869e-10 2.6170751e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.9e-05 1.97e-05 8.3e-06 ] [ 4.91e-05 -1e-06 -3.15e-05 ] [ -2.87e-05 -5.05e-05 -1.45e-05 ] [ -3.8e-06 -6.4e-06 5.08e-05 ] [ -3.56e-05 3.82e-05 -1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.04413557952e-14 3.156287942976e-14 1.329806595264e-14 ] [ 7.866687208128001e-14 -1.6021766208e-15 -5.04685635552e-14 ] [ -4.598246901696e-14 -8.090991935040001e-14 -2.32315610016e-14 ] [ -6.08827115904e-15 -1.025393037312e-14 8.139057233664001e-14 ] [ -5.703748770048e-14 6.120314691456e-14 -2.098851373248e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }