{ "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" [ [ 0.2245113 0.4062398 2.51204 ] [ 0.3734712 1.938106 1.147246 ] [ 0.9603572 2.15083 2.976354 ] [ 2.053947 0.3264748 1.110732 ] [ 2.246066 2.745531 0.3277405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.245113e-11 4.062398e-11 2.51204e-10 ] [ 3.734712e-11 1.938106e-10 1.147246e-10 ] [ 9.603572000000001e-11 2.15083e-10 2.976354000000001e-10 ] [ 2.053947e-10 3.264748e-11 1.110732e-10 ] [ 2.246066e-10 2.745531e-10 3.277405e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1590749 -6.34162 1.5507172 ] [ -3.2347504 2.3568386 -6.0942544 ] [ 1.1567684 6.6211703 8.5845272 ] [ 2.7347195 -2.4230832 -3.1133071 ] [ 1.5023373 -0.2133056 -0.9276829 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.459219355835886e-09 -1.016039538570708e-08 2.484522863781905e-09 ] [ -5.182641507702152e-09 3.776071735029272e-09 -9.764072001331687e-09 ] [ 1.853347301429566e-09 1.060828434439477e-08 1.375392889377744e-08 ] [ 4.381503683444163e-09 -3.882207285277949e-09 -4.988067890086301e-09 ] [ 2.407009718446648e-09 -3.417532482213504e-10 -1.486311866141358e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.850629332689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.257809487903041e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2782223 0.4604374 2.3835387 ] [ -0.2367156 1.990154 0.630924 ] [ 1.5089681 2.3499868 3.1527699 ] [ 2.2427574 0.2001691 1.0607732 ] [ 2.0651204 2.5664343 0.8461067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.782223e-11 4.604374e-11 2.3835387e-10 ] [ -2.367156e-11 1.990154e-10 6.30924e-11 ] [ 1.5089681e-10 2.3499868e-10 3.1527699e-10 ] [ 2.2427574e-10 2.001691e-11 1.0607732e-10 ] [ 2.0651204e-10 2.5664343e-10 8.461067e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-06 9.5e-06 -5.6e-06 ] [ 5.5e-06 -3.4e-06 1.9e-06 ] [ 5e-06 -9.6e-06 -9.2e-06 ] [ -2e-06 8.5e-06 7.5e-06 ] [ -9.7e-06 -4.9e-06 5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.0828296242e-15 1.5220678023e-14 -8.972189150399999e-15 ] [ 8.811971486999999e-15 -5.4474005556e-15 3.0441356046e-15 ] [ 8.010883169999999e-15 -1.53808956864e-14 -1.47400250328e-14 ] [ -3.204353268e-15 1.3618501389e-14 1.2016324755e-14 ] [ -1.55411133498e-14 -7.850665506599998e-15 8.6517538236e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }