{ "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" [ [ 1.239329 2.983674 3.512225 ] [ 2.999663 5.449943 1.062375 ] [ 1.178907 3.936124 1.554887 ] [ 2.122325 5.087093 3.38156 ] [ 3.136296 3.082629 1.288456 ] [ 5.117946 4.70791 1.219676 ] [ 3.839933 3.58316 3.463374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.239329e-10 2.983674e-10 3.512225e-10 ] [ 2.999663e-10 5.449943e-10 1.062375e-10 ] [ 1.178907e-10 3.936124e-10 1.554887e-10 ] [ 2.122325e-10 5.087093000000001e-10 3.38156e-10 ] [ 3.136296e-10 3.082629e-10 1.288456e-10 ] [ 5.117946e-10 4.70791e-10 1.219676e-10 ] [ 3.839933e-10 3.58316e-10 3.463374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4699664 -0.9655359 1.2508736 ] [ -0.9681026 0.6444486 0.027507 ] [ -2.2702166 1.2908976 -1.7379 ] [ -0.1540178 1.4436065 0.23557 ] [ 2.2157653 -1.0114175 -0.7236873 ] [ -0.2394029 -0.9911599 0.7493182 ] [ 0.9460082 -0.4108393 0.1983184 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.529691786415411e-10 -1.546959045523087e-09 2.004120437495931e-09 ] [ -1.551071352255694e-09 1.032520480227291e-09 4.40710723083456e-11 ] [ -3.637287960672065e-09 2.06824595456683e-09 -2.78442274928832e-09 ] [ -2.467637183470503e-10 2.312912583934915e-09 3.77424746561856e-10 ] [ 3.550047360839899e-09 -1.620469472367984e-09 -1.159474872829876e-09 ] [ -3.835657293317203e-10 -1.588013219254466e-09 1.200540101579939e-09 ] [ 1.51567222112509e-09 -6.582371213658375e-10 3.177411039544627e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.698821 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.156099046352408e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.698305 2.8923806 3.3005947 ] [ 2.8436767 5.9198679 1.218545 ] [ 1.2866893 4.1165587 1.2983772 ] [ 2.0789646 5.2433017 3.3726086 ] [ 3.1417438 2.5627981 1.4338376 ] [ 4.6510014 4.4060849 1.3505218 ] [ 3.9340182 3.6895411 3.5080681 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.698305e-10 2.8923806e-10 3.3005947e-10 ] [ 2.8436767e-10 5.9198679e-10 1.218545e-10 ] [ 1.2866893e-10 4.1165587e-10 1.2983772e-10 ] [ 2.0789646e-10 5.2433017e-10 3.3726086e-10 ] [ 3.1417438e-10 2.562798100000001e-10 1.4338376e-10 ] [ 4.6510014e-10 4.4060849e-10 1.3505218e-10 ] [ 3.9340182e-10 3.6895411e-10 3.5080681e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.9e-06 -1.27e-05 1.14e-05 ] [ 2.6e-06 2e-06 5e-06 ] [ 7.1e-06 3.1e-06 -6.2e-06 ] [ 1.01e-05 1.3e-06 -1.53e-05 ] [ -2.6e-06 -4e-07 -4e-07 ] [ -1.44e-05 7.1e-06 6e-07 ] [ 2.2e-06 -4e-07 4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.850665441919999e-15 -2.034764308416e-14 1.826481347712e-14 ] [ 4.16565921408e-15 3.2043532416e-15 8.010883104e-15 ] [ 1.137545400768e-14 4.96674752448e-15 -9.93349504896e-15 ] [ 1.618198387008e-14 2.08282960704e-15 -2.451330229824e-14 ] [ -4.16565921408e-15 -6.408706483200001e-16 -6.408706483200001e-16 ] [ -2.307134333952e-14 1.137545400768e-14 9.6130597248e-16 ] [ 3.52478856576e-15 -6.408706483200001e-16 7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864800740979e-18 } }