{ "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" [ [ 0.4523459 0.4778673 0.765296 ] [ 0.8876723 1.989638 2.471047 ] [ 2.135329 1.164008 0.2412907 ] [ 2.495776 0.5844002 2.912252 ] [ 2.604983 2.71818 1.724062 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.523459e-11 4.778673e-11 7.65296e-11 ] [ 8.876723e-11 1.989638e-10 2.471047e-10 ] [ 2.135329e-10 1.164008e-10 2.412907e-11 ] [ 2.495776e-10 5.844002e-11 2.912252e-10 ] [ 2.604983e-10 2.71818e-10 1.724062e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -184.7147114 -70.0813081 63.0934101 ] [ -103.9402726 -19.2337037 29.0533024 ] [ 188.0813396 69.8793064 -67.3465323 ] [ 20.5241596 -21.6836444 8.7673563 ] [ 80.0494848 41.1193499 -33.5675365 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.959455921228993e-07 -1.122826333929017e-07 1.010867865887666e-07 ] [ -1.665306747192988e-07 -3.081579039953446e-08 4.654852186231253e-08 ] [ 3.013395251158652e-07 1.119589909917998e-07 -1.079010395430121e-07 ] [ 3.288332867268788e-08 -3.474102811142085e-08 1.404685329008359e-08 ] [ 1.28253413053645e-07 6.588046107227483e-08 -5.378112219815067e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 37.94734 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.079834096954867e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.04129 0.674959 0.5488227 ] [ 0.5705766 1.8384513 2.7388805 ] [ 2.4968004 0.7880562 0.2847091 ] [ 2.8933048 0.596962 2.8855011 ] [ 2.6567144 3.035665 1.6560344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.129e-12 6.74959e-11 5.488227e-11 ] [ 5.705766e-11 1.8384513e-10 2.7388805e-10 ] [ 2.4968004e-10 7.880562e-11 2.847091e-11 ] [ 2.8933048e-10 5.96962e-11 2.8855011e-10 ] [ 2.6567144e-10 3.035665e-10 1.6560344e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.5e-06 2.2e-06 -2e-06 ] [ 1e-07 -5.3e-06 7.9e-06 ] [ -1.7e-06 -5.1e-06 -6.6e-06 ] [ -6e-06 7e-06 1.1e-06 ] [ 3.1e-06 1.2e-06 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.2097947936e-15 3.52478856576e-15 -3.2043532416e-15 ] [ 1.6021766208e-16 -8.491536090240001e-15 1.265719530432e-14 ] [ -2.72370025536e-15 -8.17110076608e-15 -1.057436569728e-14 ] [ -9.6130597248e-15 1.12152363456e-14 1.76239428288e-15 ] [ 4.96674752448e-15 1.92261194496e-15 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -16.556674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.652671600100722e-18 } }