{ "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" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2216693 -5.5913981 -13.2096174 ] [ -7.2907157 2.171666 -2.0034214 ] [ -4.7289077 -7.8138712 9.0641371 ] [ -1.0870858 12.1481232 -1.904182 ] [ 4.8818194 -4.8583212 2.4435102 ] [ 7.1979469 1.754294 -4.1468797 ] [ 0.8052736 2.1895073 9.7564532 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.551533700091015e-10 -8.958407313405541e-09 -2.116414016799289e-08 ] [ -1.168101424343951e-08 3.479392493386253e-09 -3.209834928690405e-09 ] [ -7.5765453588611e-09 -1.251920175458244e-08 1.452234854934591e-08 ] [ -1.741703453563665e-09 1.946343897763808e-08 -3.050835882148186e-09 ] [ 7.821536909647884e-09 -7.783888642977e-09 3.914934915126332e-09 ] [ 1.153238224093984e-08 2.810688832809715e-09 -6.644033704610119e-09 ] [ 1.290190535267451e-09 3.507977407130932e-09 1.563156121896935e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.3803119 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.211503455592027e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5092771 1.9228608 0.2130699 ] [ 1.0441715 2.6309673 1.9664406 ] [ 1.9817123 1.5126369 3.9101837 ] [ 2.7703073 4.408911 2.4815071 ] [ 4.1513667 1.0969313 3.0671007 ] [ 4.3255217 2.8358066 1.4743058 ] [ 2.6671432 3.6465551 4.7465461 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5092771e-10 1.9228608e-10 2.130699e-11 ] [ 1.0441715e-10 2.6309673e-10 1.9664406e-10 ] [ 1.9817123e-10 1.5126369e-10 3.9101837e-10 ] [ 2.7703073e-10 4.408911e-10 2.4815071e-10 ] [ 4.1513667e-10 1.0969313e-10 3.0671007e-10 ] [ 4.325521700000001e-10 2.8358066e-10 1.4743058e-10 ] [ 2.6671432e-10 3.6465551e-10 4.7465461e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.7e-06 5.8e-06 4.28e-05 ] [ 2.16e-05 5.4e-06 7e-07 ] [ -3.4e-06 -4.9e-06 -1.57e-05 ] [ 2.45e-05 -2.07e-05 -1.22e-05 ] [ 6.9e-06 1.07e-05 -6.3e-06 ] [ -2.83e-05 1.02e-05 9.4e-06 ] [ -1.26e-05 -6.5e-06 -1.87e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.393893660096e-14 9.292624400640001e-15 6.857315937023999e-14 ] [ 3.460701500928e-14 8.65175375232e-15 1.12152363456e-15 ] [ -5.44740051072e-15 -7.850665441919999e-15 -2.515417294656e-14 ] [ 3.92533272096e-14 -3.316505605055999e-14 -1.954655477376e-14 ] [ 1.105501868352e-14 1.714328984256e-14 -1.009371271104e-14 ] [ -4.534159836864e-14 1.634220153216e-14 1.506046023552e-14 ] [ -2.018742542208e-14 -1.04141480352e-14 -2.996070280896e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.906007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907552606248115e-18 } }