{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.7967135 -16.5247478 4.036645 ] [ -10.0353811 10.1489395 5.4781573 ] [ 17.1715062 -11.3141828 -17.286831 ] [ 13.929068 0.1924048 21.0050143 ] [ -6.2684796 17.4975864 -13.2329855 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.370694843437574e-08 -2.647556458977624e-08 6.467418245469216e-09 ] [ -1.607845297923819e-08 1.626039359281364e-08 8.776975551124853e-09 ] [ 2.751178577756225e-08 -1.812731916561748e-08 -2.769655647592069e-08 ] [ 2.231682709913341e-08 3.082664722896998e-10 3.365374283102968e-08 ] [ -1.004321146308174e-08 2.803422385050804e-08 -2.12015799914854e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 100.5967 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.611736808696314e-17 } "relaxed-configuration-positions" { "source-value" [ [ -2.1352122 -3.7836309 2.0086202 ] [ -3.4902326 5.6884991 5.0381296 ] [ 6.5478844 -2.7163501 -2.9934071 ] [ 5.4810533 1.3067941 6.1163492 ] [ 1.1884958 5.6876152 -3.7998278 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.1352122e-10 -3.7836309e-10 2.0086202e-10 ] [ -3.4902326e-10 5.6884991e-10 5.038129600000001e-10 ] [ 6.5478844e-10 -2.7163501e-10 -2.9934071e-10 ] [ 5.481053300000001e-10 1.3067941e-10 6.116349200000001e-10 ] [ 1.1884958e-10 5.6876152e-10 -3.7998278e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 7.1054274e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.138414966107173e-33 } }