{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.3805435e-10 2.904435e-11 -8.527060000000001e-12 ] [ 1.0744835e-10 -1.477795e-11 2.9453359e-10 ] [ 3.2800689e-10 2.2898033e-10 2.4200005e-10 ] ] "source-value" [ [ 2.3805435 0.2904435 -0.0852706 ] [ 1.0744835 -0.1477795 2.9453359 ] [ 3.2800689 2.2898033 2.4200005 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 8.747884349568e-14 1.2240629382912e-13 4.870616927232e-14 ] [ -1.0718561593152e-13 -8.892080245440001e-14 1.0510278632448e-13 ] [ 1.970677243584e-14 -3.332527371264e-14 -1.5364873793472e-13 ] ] "source-value" [ [ 5.46e-05 7.64e-05 3.04e-05 ] [ -6.69e-05 -5.55e-05 6.56e-05 ] [ 1.23e-05 -2.08e-05 -9.59e-05 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.499913370968456e-19 "source-value" -5.9293796 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.031572542816535e-07 -1.21409147005415e-07 -6.6147045782229e-07 ] [ -7.709100276800586e-07 -7.556959771860505e-07 4.441583787010314e-07 ] [ 6.67752773398405e-07 8.771051241914654e-07 2.173120791212586e-07 ] ] "source-value" [ [ 64.3856944 -75.7776299 -412.8573899 ] [ -481.1641973 -471.6683338 277.2218574 ] [ 416.7785029 547.4459637 135.6355325 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 6.292886256806004e-17 "source-value" 392.77107 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.099042e-10 1.368378e-11 4.078968e-11 ] [ 1.791278e-10 4.590135e-11 2.273028e-10 ] [ 2.844776e-10 1.836616e-10 2.599141e-10 ] ] "source-value" [ [ 2.099042 0.1368378 0.4078968 ] [ 1.791278 0.4590135 2.273028 ] [ 2.844776 1.836616 2.599141 ] ] } "instance-id" 1 }