{ "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" [ [ 2.264039 2.962814 1.145416 ] [ 2.607686 1.947625 3.138097 ] [ 3.569117 1.227918 0.4731936 ] [ 5.155867 2.512325 3.932817 ] [ 4.543954 3.206398 1.939601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.264039e-10 2.962814e-10 1.145416e-10 ] [ 2.607686e-10 1.947625e-10 3.138097e-10 ] [ 3.569117e-10 1.227918e-10 4.731936e-11 ] [ 5.155867e-10 2.512325e-10 3.932817e-10 ] [ 4.543954e-10 3.206398e-10 1.939601e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4971447 1.7476702 -0.6617887 ] [ 4.6648361 -0.8300181 -3.1516681 ] [ -0.2883702 1.1017697 4.9032866 ] [ -1.539335 -1.0793686 0.8315931 ] [ -2.3399862 -0.9400533 -1.9214229 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.965136154946298e-10 2.80007633530886e-09 -1.060302383049625e-09 ] [ 7.473891339283851e-09 -1.329835594660836e-09 -5.049528946341157e-09 ] [ -4.620199925754202e-10 1.76522965484583e-09 7.855931155601922e-09 ] [ -2.466286548579168e-09 -1.729339136145627e-09 1.332359022838597e-09 ] [ -3.749071182634632e-09 -1.506131419565889e-09 -3.078458849049736e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.754858 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.684424177242384e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1950187 3.0976942 1.0930771 ] [ 2.865423 1.9221546 2.9935289 ] [ 3.6609783 1.247614 0.9040583 ] [ 5.0058084 2.3183207 3.8442798 ] [ 4.4134346 3.2712965 1.7941805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1950187e-10 3.0976942e-10 1.0930771e-10 ] [ 2.865423e-10 1.9221546e-10 2.9935289e-10 ] [ 3.6609783e-10 1.247614e-10 9.040583e-11 ] [ 5.005808400000001e-10 2.3183207e-10 3.8442798e-10 ] [ 4.413434600000001e-10 3.2712965e-10 1.7941805e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.21e-05 6e-07 -2.99e-05 ] [ -2.73e-05 4.3e-06 2.47e-05 ] [ 1.22e-05 -1.64e-05 7e-07 ] [ 2.77e-05 -2.49e-05 2.2e-06 ] [ 9.5e-06 3.63e-05 2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.540810331968e-14 9.6130597248e-16 -4.790508096192e-14 ] [ -4.373942174784e-14 6.889359469440001e-15 3.957376253376001e-14 ] [ 1.954655477376e-14 -2.627569658112e-14 1.12152363456e-15 ] [ 4.438029239616e-14 -3.989419785791999e-14 3.52478856576e-15 ] [ 1.52206778976e-14 5.815901133504e-14 3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.979559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.040860570289423e-18 } }