{ "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" [ [ 1.492003 2.387549 2.170669 ] [ 2.788135 3.420279 0.7006935 ] [ 2.516882 3.82705 3.771673 ] [ 3.610971 1.743132 2.445693 ] [ 4.42605 4.234183 2.406002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.492003e-10 2.387549e-10 2.170669e-10 ] [ 2.788135e-10 3.420279e-10 7.006935e-11 ] [ 2.516882e-10 3.82705e-10 3.771673e-10 ] [ 3.610971e-10 1.743132e-10 2.445693e-10 ] [ 4.42605e-10 4.234183e-10 2.406002e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8363661 -0.2110144 0.9485625 ] [ 1.4804871 0.6738138 -0.1684556 ] [ 0.457246 -0.3605119 -0.5970253 ] [ 1.0513827 1.0095224 0.0723394 ] [ -1.1527498 -1.1118099 -0.2554209 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.942182832649675e-09 -3.380823383321395e-10 1.5197646608676e-09 ] [ 2.372001819015992e-09 1.079568717132407e-09 -2.698956239628365e-10 ] [ 7.325888511543168e-10 -5.776037377001874e-10 -9.565399776861062e-10 ] [ 1.68450078145358e-09 1.617433187453906e-09 1.159004954426995e-10 ] [ -1.846908779191876e-09 -1.781315828553986e-09 -4.092293944436948e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.279462775408902 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.458631829144024e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3579429 2.5858494 2.1787893 ] [ 2.972056 3.2618228 0.6044913 ] [ 2.6199413 3.5797667 3.8993117 ] [ 3.649955 1.929185 2.4870992 ] [ 4.2341458 4.2555691 2.325039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3579429e-10 2.5858494e-10 2.1787893e-10 ] [ 2.972056e-10 3.2618228e-10 6.044913e-11 ] [ 2.6199413e-10 3.5797667e-10 3.8993117e-10 ] [ 3.649955e-10 1.929185e-10 2.4870992e-10 ] [ 4.2341458e-10 4.2555691e-10 2.325039e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.8e-06 2.5e-05 -7e-06 ] [ -8.7e-06 -3.96e-05 -4.7e-05 ] [ 2.7e-06 -2.84e-05 3.61e-05 ] [ -1.9e-06 2.67e-05 4.3e-06 ] [ 6.2e-06 1.63e-05 1.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.88391791744e-15 4.005441552e-14 -1.12152363456e-14 ] [ -1.393893660096e-14 -6.344619418368e-14 -7.530230117759999e-14 ] [ 4.32587687616e-15 -4.550181603071999e-14 5.783857601088001e-14 ] [ -3.04413557952e-15 4.277811577536e-14 6.889359469440001e-15 ] [ 9.93349504896e-15 2.611547891904e-14 2.178960204288e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }