{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2403387 -0.6668525 -5.5675059 ] [ -2.529378 -0.9004654 5.9244728 ] [ -3.1918273 4.1879102 -2.5743041 ] [ 0.4981039 -2.8765519 -2.5237372 ] [ 3.5178467 0.9478778 -2.8634642 ] [ 2.1140859 -1.8162146 2.9943343 ] [ 1.8315076 1.1242964 4.6102044 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.589418287813465e-09 -1.068415485022032e-09 -8.920127789146063e-09 ] [ -4.052510296765862e-09 -1.44270461171932e-09 9.492051810725513e-09 ] [ -5.113871077691188e-09 6.709771812449852e-09 -4.124489843849585e-09 ] [ 7.980504233093011e-10 -4.60874420269782e-09 -4.043472738883254e-09 ] [ 5.636211738298432e-09 1.518667650535338e-09 -4.587775395737776e-09 ] [ 3.387139003342927e-09 -2.909896570475624e-09 4.797452410319533e-09 ] [ 2.934398657537518e-09 1.801321406929605e-09 7.386361706789291e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.447724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.154562899577106e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5257899 1.5628122 1.589583 ] [ 1.8195249 1.9441432 4.0759952 ] [ 2.5630225 3.7602639 2.2088284 ] [ 3.3316824 0.0367908 1.6897557 ] [ 5.0635281 3.3537105 2.4256138 ] [ 4.3425931 1.1610713 3.5130851 ] [ 3.7399441 3.5470243 4.6310109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5257899e-10 1.5628122e-10 1.589583e-10 ] [ 1.8195249e-10 1.9441432e-10 4.075995200000001e-10 ] [ 2.5630225e-10 3.7602639e-10 2.2088284e-10 ] [ 3.3316824e-10 3.67908e-12 1.6897557e-10 ] [ 5.0635281e-10 3.3537105e-10 2.4256138e-10 ] [ 4.3425931e-10 1.1610713e-10 3.5130851e-10 ] [ 3.7399441e-10 3.5470243e-10 4.6310109e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.01e-05 2.41e-05 -2.78e-05 ] [ 7.09e-05 -5.88e-05 -1.01e-05 ] [ -1.21e-05 8.7e-06 -7.07e-05 ] [ 5.6e-06 2.18e-05 3.58e-05 ] [ 1.46e-05 5e-07 -9.3e-06 ] [ -2.48e-05 -2.6e-06 2.38e-05 ] [ 5.8e-06 6.2e-06 5.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.629081491008e-14 3.861245656128e-14 -4.454051005824e-14 ] [ 1.1359432241472e-13 -9.420798530304e-14 -1.618198387008e-14 ] [ -1.938633711168e-14 1.393893660096e-14 -1.1327388709056e-13 ] [ 8.972189076479999e-15 3.492745033344e-14 5.735792302464001e-14 ] [ 2.339177866368e-14 8.010883104e-16 -1.490024257344e-14 ] [ -3.973398019584e-14 -4.16565921408e-15 3.813180357504e-14 ] [ 9.292624400640001e-15 9.93349504896e-15 9.340689699264e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.814041 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.693906339137265e-18 } }