{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.3128562 -12.2126231 -4.0910334 ] [ -4.2953292 6.0508665 -19.4260682 ] [ -14.0681185 -4.9132513 20.5182572 ] [ 0.901431 15.4878252 6.363112 ] [ 23.7748729 -4.4128173 -3.3642676 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.011431061411233e-08 -1.956677920946202e-08 -6.554558068391934e-09 ] [ -6.881876022879568e-09 9.694556841881922e-09 -3.112399230410634e-08 ] [ -2.253961055934396e-08 -7.871896364975207e-09 3.287387198540127e-08 ] [ 1.444251673464365e-09 2.481423144247709e-08 1.019482928193193e-08 ] [ 3.809154552287149e-08 -7.070112709921781e-09 -5.390150894834925e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 7.0121233 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.123466001342694e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.375467 0.3849553 2.2578416 ] [ 1.9522861 2.6706899 1.1078336 ] [ 1.5684532 1.6765376 4.3570644 ] [ 3.0648775 3.5094285 3.2952627 ] [ 4.6397752 1.4943466 2.8647597 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.375467e-10 3.849553e-11 2.2578416e-10 ] [ 1.9522861e-10 2.6706899e-10 1.1078336e-10 ] [ 1.5684532e-10 1.6765376e-10 4.3570644e-10 ] [ 3.0648775e-10 3.5094285e-10 3.2952627e-10 ] [ 4.6397752e-10 1.4943466e-10 2.8647597e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.3e-06 -3.47e-05 -6.5e-06 ] [ -8.4e-06 1.02e-05 -2.08e-05 ] [ 4e-06 -1.7e-06 6.8e-06 ] [ 6.3e-06 2.9e-05 1.44e-05 ] [ 4.3e-06 -2.9e-06 6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.009371271104e-14 -5.559552874176001e-14 -1.04141480352e-14 ] [ -1.345828361472e-14 1.634220153216e-14 -3.332527371264e-14 ] [ 6.4087064832e-15 -2.72370025536e-15 1.089480102144e-14 ] [ 1.009371271104e-14 4.64631220032e-14 2.307134333952e-14 ] [ 6.889359469440001e-15 -4.646312200320001e-15 9.77327738688e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.8977283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.425573226049053e-18 } }