{ "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" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5383574 -9.1024862 -2.50172 ] [ -0.992076 0.6940293 -7.4782229 ] [ -8.9693368 0.137873 -2.0288752 ] [ -4.1653133 -1.4486122 9.2577652 ] [ -0.4552726 9.6929362 1.6397118 ] [ 7.2967513 2.867987 -4.3054647 ] [ 7.8236048 -2.841727 5.4168057 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.625436399146739e-10 -1.458379058079463e-08 -4.008197295787777e-09 ] [ -1.589480973256781e-09 1.111957518610189e-09 -1.198143389551117e-08 ] [ -1.437046172504109e-08 2.208968972395584e-10 -3.250616411960924e-09 ] [ -6.673567587567297e-09 -2.320932599445654e-09 1.483257496429584e-08 ] [ -7.2942711581083e-10 1.552979576654599e-08 2.627107910809886e-09 ] [ 1.169068434065201e-08 4.59502172015833e-09 -6.898114884019686e-09 ] [ 1.253479670093866e-08 -4.552948562096122e-09 8.678679451956179e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 57.008495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.133767787599371e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7108181 -2.2426871 1.9298404 ] [ 1.8436212 3.1109751 -3.3960174 ] [ -3.0126604 2.7388198 2.1085741 ] [ 0.5110836 1.7176456 8.4774774 ] [ 2.4938874 7.4904572 4.172843 ] [ 8.0384217 4.3695967 0.3540248 ] [ 7.5837814 0.7433257 6.7310114 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7108181e-10 -2.2426871e-10 1.9298404e-10 ] [ 1.8436212e-10 3.1109751e-10 -3.3960174e-10 ] [ -3.0126604e-10 2.7388198e-10 2.1085741e-10 ] [ 5.110836e-11 1.7176456e-10 8.4774774e-10 ] [ 2.4938874e-10 7.4904572e-10 4.172843000000001e-10 ] [ 8.038421700000001e-10 4.3695967e-10 3.540248e-11 ] [ 7.583781400000001e-10 7.433257e-11 6.7310114e-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 ] [ 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 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 3.1086245e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.98056549674609e-34 } }