{ "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" [ [ -1.0788286 -0.5267767 3.1078696 ] [ 5.5237277 -0.5113248 -3.6282584 ] [ -0.8657152 4.4569575 -3.1610916 ] [ -0.2358384 -3.8500001 -1.8292679 ] [ -3.3433455 0.4311441 5.5107482 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.728473960770395e-09 -8.439893131221754e-10 4.979356013615048e-09 ] [ 8.849987380605357e-09 -8.192326401952359e-10 -5.813110782701214e-09 ] [ -1.387028653711196e-09 7.140833106399216e-09 -5.064627057727264e-09 ] [ -3.778547707668787e-10 -6.168380150297662e-09 -2.930810262559912e-09 ] [ -5.356629995356886e-09 6.907689972158573e-10 8.829191929155684e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.7504263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.611021956693448e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1370926 2.5563917 0.6166236 ] [ 2.0842574 3.0065187 3.0748189 ] [ 2.470789 0.4643728 1.2105442 ] [ 2.0621176 4.7545492 0.6916988 ] [ 4.0768605 2.9324975 2.1502346 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1370926e-10 2.5563917e-10 6.166236e-11 ] [ 2.0842574e-10 3.0065187e-10 3.0748189e-10 ] [ 2.470789e-10 4.643728e-11 1.2105442e-10 ] [ 2.0621176e-10 4.754549199999999e-10 6.916988e-11 ] [ 4.0768605e-10 2.9324975e-10 2.1502346e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0046814 0.0934184 0.0047275 ] [ 0.0098542 0.0028874 0.013095 ] [ 0.0014055 -0.0556174 -0.0031482 ] [ -0.0057047 -0.041069 -0.0194261 ] [ -0.0102364 0.0003806 0.0047518 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.50042963261312e-12 1.496727764325427e-10 7.574289974832e-12 ] [ 1.578816885668736e-11 4.62612477489792e-12 2.0980502849376e-11 ] [ 2.2518592405344e-12 -8.910889798968192e-11 -5.04397243760256e-12 ] [ -9.13993696867776e-12 -6.57997916396352e-11 -3.112404325332289e-11 ] [ -1.640052076115712e-11 6.0978842187648e-13 7.613222866717439e-12 ] ] } "relaxed-potential-energy" { "source-value" -8.5357347 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.36757545776913e-18 } }