{ "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" [ [ -6.2317054 5.6628491 -12.381384 ] [ -3.844254 -6.6767835 12.4714959 ] [ 9.2195592 0.0723808 1.208765 ] [ 2.6274259 1.1052261 -7.8994748 ] [ -1.7710258 -0.1636726 6.6005979 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.984292781851624e-09 9.072884509887928e-09 -1.983716414138146e-08 ] [ -6.159173933961035e-09 -1.069738651397674e-08 1.99815393220068e-08 ] [ 1.477136232601973e-08 1.159668265102272e-10 1.93665503899701e-09 ] [ 4.20960038454642e-09 1.770767432706947e-09 -1.265635394543182e-08 ] [ -2.837496154971157e-09 -2.622324153460284e-10 1.057532372580947e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.5673224 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.715480595224802e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2235866 1.3067306 1.5385221 ] [ 1.1445782 -0.4622007 2.8377528 ] [ 3.2317512 0.6794903 2.9126127 ] [ 3.3324545 3.5568803 -0.1173363 ] [ 2.3107387 2.4484547 1.6134392 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.235866e-11 1.3067306e-10 1.5385221e-10 ] [ 1.1445782e-10 -4.622007e-11 2.8377528e-10 ] [ 3.2317512e-10 6.794903e-11 2.9126127e-10 ] [ 3.3324545e-10 3.5568803e-10 -1.173363e-11 ] [ 2.3107387e-10 2.4484547e-10 1.6134392e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.88e-05 2.09e-05 2.8e-06 ] [ 2.07e-05 -1.02e-05 -2.05e-05 ] [ 2.3e-06 5.8e-06 1.72e-05 ] [ -3.92e-05 -5.87e-05 6.23e-05 ] [ 3.5e-05 4.23e-05 -6.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.012092071919999e-14 3.34854916506e-14 4.486094575199999e-15 ] [ 3.316505632379999e-14 -1.63422016668e-14 -3.2844620997e-14 ] [ 3.685006258199999e-15 9.2926244772e-15 2.75574381048e-14 ] [ -6.280532405279998e-14 -9.404776841579999e-14 9.981560429819998e-14 ] [ 5.607618218999999e-14 6.77720716182e-14 -9.885429831779999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.301703 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.81073244710077e-18 } }