{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.053874 2.225583 2.945298 ] [ 1.808711 4.658327 2.287931 ] [ 4.038397 2.121863 2.154331 ] [ 3.514533 3.432892 3.895035 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.053874e-10 2.225583e-10 2.945298000000001e-10 ] [ 1.808711e-10 4.658327e-10 2.287931e-10 ] [ 4.038397e-10 2.121863e-10 2.154331e-10 ] [ 3.514533e-10 3.432892e-10 3.895035e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.4548118 -3.6981542 -0.6201643 ] [ -1.5806219 2.2258577 -0.9389595 ] [ 5.4382889 -3.1902703 -4.4928901 ] [ 3.5971448 4.6625668 6.0520139 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.194392517842397e-08 -5.925096199353328e-09 -9.936127425147974e-10 ] [ -2.532435454504476e-09 3.56621716816766e-09 -1.504378958778058e-09 ] [ 8.71309933273615e-09 -5.111376488692602e-09 -7.198403478043775e-09 ] [ 5.763261300192292e-09 7.470255519878269e-09 9.69639517933663e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.34624947 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.54752805798391e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.6667554 2.1255608 2.0715225 ] [ 1.7073243 4.3746803 2.9757545 ] [ 4.0004337 1.8446526 2.665542 ] [ 4.0410017 4.0937713 3.569776 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6667554e-10 2.1255608e-10 2.0715225e-10 ] [ 1.7073243e-10 4.3746803e-10 2.9757545e-10 ] [ 4.000433700000001e-10 1.8446526e-10 2.665542e-10 ] [ 4.0410017e-10 4.0937713e-10 3.569776e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.11e-05 1.5e-05 1.17e-05 ] [ 5.6e-06 -5.1e-06 3e-07 ] [ -7.1e-06 4.2e-06 2e-07 ] [ -1.95e-05 -1.41e-05 -1.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.380592669888e-14 2.4032649312e-14 1.874546646336e-14 ] [ 8.972189076479999e-15 -8.17110076608e-15 4.8065298624e-16 ] [ -1.137545400768e-14 6.72914180736e-15 3.2043532416e-16 ] [ -3.12424441056e-14 -2.259069035328e-14 -1.954655477376e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.173253 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.288465010083462e-19 } }