{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0097829 -4.6281961 -3.2071683 ] [ -5.412099 3.1544294 3.5622577 ] [ -1.8426155 0.4032711 -11.0340279 ] [ 8.2779356 -8.0373953 5.1209779 ] [ 1.9865618 9.1078909 5.5579605 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.822203835792758e-09 -7.415187648989927e-09 -5.138450111565502e-09 ] [ -8.671138558694766e-09 5.053953078282639e-09 5.707366051226582e-09 ] [ -2.952195499546227e-09 6.461115335874773e-10 -1.767846168028409e-08 ] [ 1.326271499607677e-08 -1.287732694788142e-08 8.204711134610387e-09 ] [ 3.182822897956981e-09 1.459244998500123e-08 8.904834445794957e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3336622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.495417548648903e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.427042 0.891025 0.7886957 ] [ 2.3111369 2.2074964 2.8231143 ] [ 4.0623136 2.436584 -0.1182417 ] [ 4.5089562 1.3400792 2.0631678 ] [ 3.9464532 3.7530208 1.9162044 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.427042e-10 8.91025e-11 7.886957e-11 ] [ 2.3111369e-10 2.2074964e-10 2.8231143e-10 ] [ 4.062313600000001e-10 2.436584e-10 -1.182417e-11 ] [ 4.5089562e-10 1.3400792e-10 2.0631678e-10 ] [ 3.9464532e-10 3.7530208e-10 1.9162044e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 2.35e-05 -1.69e-05 ] [ 2.39e-05 -1.9e-05 1.82e-05 ] [ 2.06e-05 -3.15e-05 4.96e-05 ] [ -1.88e-05 2.06e-05 -2.84e-05 ] [ -1.8e-05 6.4e-06 -2.25e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.23367600818e-14 3.765115089899999e-14 -2.70767851146e-14 ] [ 3.82920215526e-14 -3.0441356046e-14 2.915961473879999e-14 ] [ 3.300483866039999e-14 -5.046856397099999e-14 7.94679610464e-14 ] [ -3.012092071919999e-14 3.300483866039999e-14 -4.550181640559999e-14 ] [ -2.8839179412e-14 1.02539304576e-14 -3.6048974265e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.867937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.221888462318406e-18 } }