{ "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" [ [ 0.9991242 0.9479007 1.187372 ] [ 1.085399 0.1016804 2.948528 ] [ 2.969901 0.5974891 1.991295 ] [ 2.924101 2.886024 0.3835606 ] [ 2.264584 2.996261 2.274235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.991242000000001e-11 9.479007e-11 1.187372e-10 ] [ 1.085399e-10 1.016804e-11 2.948528e-10 ] [ 2.969901e-10 5.974891e-11 1.991295e-10 ] [ 2.924101e-10 2.886024e-10 3.835606e-11 ] [ 2.264584e-10 2.996261e-10 2.274235e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1446666 2.288685 -4.4257542 ] [ -1.0959842 -1.9755545 4.2715983 ] [ 3.3053944 0.4379325 0.1430294 ] [ 0.9888985 -0.3254239 -2.846719 ] [ -1.0536421 -0.4256391 2.8578455 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.436134714240224e-09 3.66687762958629e-09 -7.090839967067362e-09 ] [ -1.755960276473182e-09 -3.165187259093553e-09 6.843854986094121e-09 ] [ 5.295825673834449e-09 7.016452187692049e-10 2.291583626550396e-10 ] [ 1.584390070097649e-09 -5.213865687251525e-10 -4.560946665363846e-09 ] [ -1.688120753218691e-09 -6.819490205367892e-10 4.578773283682046e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.650980232689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.386039839001128e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7094954 1.1254175 0.6430569 ] [ 1.3400867 0.6683904 2.8947955 ] [ 3.4665579 0.4287466 1.8471606 ] [ 2.7571569 2.343352 0.6191998 ] [ 1.9698123 2.9634487 2.7807778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.094954e-11 1.1254175e-10 6.430569e-11 ] [ 1.3400867e-10 6.683904000000001e-11 2.8947955e-10 ] [ 3.4665579e-10 4.287466e-11 1.8471606e-10 ] [ 2.7571569e-10 2.343352e-10 6.191997999999999e-11 ] [ 1.9698123e-10 2.9634487e-10 2.7807778e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.38e-05 5.6e-06 4.5e-06 ] [ -1.3e-06 -4e-06 5.7e-06 ] [ -9.1e-06 7.2e-06 -6e-06 ] [ -3.5e-06 -4.3e-06 5.8e-06 ] [ 0.0 -4.4e-06 -1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.21100375492e-14 8.972189150399999e-15 7.209794853e-15 ] [ -2.0828296242e-15 -6.408706535999999e-15 9.1324068138e-15 ] [ -1.45798073694e-14 1.15356717648e-14 -9.613059803999999e-15 ] [ -5.607618218999999e-15 -6.8893595262e-15 9.2926244772e-15 ] [ 0.0 -7.0495771896e-15 -1.602176634e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }