{ "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" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3618678 -2.5521314 -11.6227362 ] [ -3.3917968 0.8505995 7.6026672 ] [ -0.6588116 -5.2781526 0.9768338 ] [ -2.320689 6.9795259 -0.459815 ] [ 10.7331652 0.0001587 3.5030502 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.98848261218033e-09 -4.088965262289573e-09 -1.862167620936583e-08 ] [ -5.434257535464254e-09 1.362810632564169e-09 1.2180815643563e-08 ] [ -1.055532543031841e-09 -8.456532696734735e-09 1.565060276767223e-09 ] [ -3.718153659947731e-09 1.118243322124808e-08 -7.36704842893152e-10 ] [ 1.719642635062416e-08 2.5426542972096e-13 5.612505131928764e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.2733428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.448826547624011e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8216509 2.4598278 -0.1525619 ] [ 1.4483086 2.8808376 3.0522157 ] [ 2.6689075 1.1167821 1.7743641 ] [ 2.4635386 4.3689486 1.3232038 ] [ 4.4287114 2.8879337 1.7466983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8216509e-10 2.4598278e-10 -1.525619e-11 ] [ 1.4483086e-10 2.8808376e-10 3.0522157e-10 ] [ 2.6689075e-10 1.1167821e-10 1.7743641e-10 ] [ 2.4635386e-10 4.368948600000001e-10 1.3232038e-10 ] [ 4.4287114e-10 2.8879337e-10 1.7466983e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 -8.7e-06 1.3e-06 ] [ -8e-07 -6.5e-06 4e-07 ] [ -6.1e-06 2.12e-05 -4.5e-06 ] [ 7e-06 -8.5e-06 3.3e-06 ] [ 5e-07 2.5e-06 -5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-16 -1.393893660096e-14 2.08282960704e-15 ] [ -1.28174129664e-15 -1.04141480352e-14 6.408706483200001e-16 ] [ -9.77327738688e-15 3.396614436096001e-14 -7.2097947936e-15 ] [ 1.12152363456e-14 -1.36185012768e-14 5.28718284864e-15 ] [ 8.010883104e-16 4.005441552e-15 -8.010883104e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }