{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.3492044 -2.0686023 5.915482 ] [ -0.737356 1.1944991 0.1737313 ] [ -4.1170944 2.3768975 -5.9762733 ] [ 4.6230568 -7.1688937 -4.4754216 ] [ 2.1145901 -1.8929935 5.193059 ] [ 1.4678119 3.7409431 -4.2324477 ] [ 3.998196 3.8181499 3.4018702 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.177472347116049e-08 -3.314266242793108e-09 9.477646961163226e-09 ] [ -1.181374544406605e-09 1.913798531586642e-09 2.78348227161191e-10 ] [ -6.596312393306604e-09 3.808209604537968e-09 -9.575045360771263e-09 ] [ 7.406953521590461e-09 -1.148583388314041e-08 -7.170415855743328e-09 ] [ 3.387946820795134e-09 -3.032909929026365e-09 8.320197720235028e-09 ] [ 2.351693909912028e-09 5.993651574563077e-09 -6.781128753698732e-09 ] [ 6.405816156576077e-09 6.117350504489858e-09 5.45039690143622e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.8739398 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.002382536346628e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5467111 3.1780084 4.7564322 ] [ 1.6819331 3.9974172 2.7034353 ] [ 3.416814 3.567461 1.1439502 ] [ 4.3203746 1.5442232 1.9850914 ] [ 4.6957379 2.3556973 4.1800955 ] [ 5.1237807 5.1176073 1.7007005 ] [ 5.9885676 4.2982335 3.7537098 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5467111e-10 3.1780084e-10 4.7564322e-10 ] [ 1.6819331e-10 3.9974172e-10 2.7034353e-10 ] [ 3.416814e-10 3.567461e-10 1.1439502e-10 ] [ 4.3203746e-10 1.5442232e-10 1.9850914e-10 ] [ 4.6957379e-10 2.3556973e-10 4.1800955e-10 ] [ 5.1237807e-10 5.1176073e-10 1.7007005e-10 ] [ 5.9885676e-10 4.298233500000001e-10 3.7537098e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.76e-05 -3.5e-06 6.1e-06 ] [ -4.9e-06 -1.41e-05 -1.14e-05 ] [ -6e-07 5.6e-06 -1.6e-06 ] [ -1.19e-05 5.9e-06 6.8e-06 ] [ -1.4e-05 -9.3e-06 7.2e-06 ] [ 1.23e-05 9.4e-06 -2.7e-06 ] [ 1.5e-06 6e-06 -4.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.819830852608e-14 -5.6076181728e-15 9.77327738688e-15 ] [ -7.850665441919999e-15 -2.259069035328e-14 -1.826481347712e-14 ] [ -9.6130597248e-16 8.972189076479999e-15 -2.56348259328e-15 ] [ -1.906590178752e-14 9.45284206272e-15 1.089480102144e-14 ] [ -2.24304726912e-14 -1.490024257344e-14 1.153567166976e-14 ] [ 1.970677243584e-14 1.506046023552e-14 -4.32587687616e-15 ] [ 2.4032649312e-15 9.6130597248e-15 -6.889359469440001e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.151319 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.786638259288284e-18 } }