{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0409962 0.6822116 1.595736 ] [ 0.3790876 1.575629 0.6188876 ] [ 0.3154214 2.976467 2.437822 ] [ 1.63698 0.1180447 0.631717 ] [ 1.584423 0.2949968 2.813326 ] [ 2.305753 1.803926 1.00695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.099619999999999e-12 6.822116000000001e-11 1.595736e-10 ] [ 3.790876e-11 1.575629e-10 6.188876e-11 ] [ 3.154214e-11 2.976467e-10 2.437822e-10 ] [ 1.63698e-10 1.180447e-11 6.31717e-11 ] [ 1.584423e-10 2.949968e-11 2.813326e-10 ] [ 2.305753e-10 1.803926e-10 1.00695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -90.6497951 -121.8671484 145.2175945 ] [ 17.8963828 145.8207246 -137.3584902 ] [ -0.7946276 2.2103433 -0.1873758 ] [ 31.2799953 -56.3371296 -28.4206297 ] [ 7.775696 -5.3640907 19.8077378 ] [ 34.4923486 35.5373007 0.9411635 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.452369823895304e-07 -1.952526960100441e-07 2.326642348367146e-07 ] [ 2.867316611904725e-08 2.336305557822354e-07 -2.200725616668259e-07 ] [ -1.273133762962414e-09 3.541360359201921e-09 -3.002091260636966e-10 ] [ 5.011607716839388e-08 -9.026203192809965e-08 -4.553486845375412e-08 ] [ 1.245803834164808e-08 -8.594220711390707e-09 3.173549441409643e-08 ] [ 5.526283452340361e-08 5.693703234787947e-08 1.507910156050301e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 70.526616 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.129960952993392e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.2187727 -0.08112 1.4536812 ] [ 0.1195887 2.2377624 0.7498348 ] [ 0.5180782 3.0622895 3.0673398 ] [ 2.4440667 -0.4149701 0.383135 ] [ 0.6254197 0.5531019 3.8289402 ] [ 2.3367352 2.0942114 -0.3784924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.187727e-11 -8.112e-12 1.4536812e-10 ] [ 1.195887e-11 2.2377624e-10 7.498348e-11 ] [ 5.180782000000001e-11 3.0622895e-10 3.0673398e-10 ] [ 2.4440667e-10 -4.149701e-11 3.83135e-11 ] [ 6.254197000000001e-11 5.531019000000001e-11 3.8289402e-10 ] [ 2.3367352e-10 2.0942114e-10 -3.784924e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.46e-05 -3.83e-05 -1.2e-06 ] [ 2.97e-05 1.63e-05 4.36e-05 ] [ -3.5e-06 1.49e-05 -2.61e-05 ] [ -3.12e-05 -1.9e-06 -9.6e-06 ] [ -2.62e-05 9.8e-06 -2.06e-05 ] [ -2.35e-05 -9e-07 1.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.747884349568e-14 -6.136336457664001e-14 -1.92261194496e-15 ] [ 4.758464563776e-14 2.611547891904e-14 6.985490066688e-14 ] [ -5.6076181728e-15 2.387243164992e-14 -4.181680980288e-14 ] [ -4.998791056896e-14 -3.04413557952e-15 -1.538089555968e-14 ] [ -4.197702746496e-14 1.570133088384e-14 -3.300483838848e-14 ] [ -3.76511505888e-14 -1.44195895872e-15 2.24304726912e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.238735 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.761949818916669e-18 } }