{ "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" [ [ 0.8494568 1.09498 0.2360667 ] [ 0.557157 2.835915 1.114432 ] [ 0.135541 1.869398 2.917972 ] [ 1.620291 0.3348641 1.837353 ] [ 2.814436 1.836887 0.4161362 ] [ 2.451507 2.913738 2.050042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.494568e-11 1.09498e-10 2.360667e-11 ] [ 5.57157e-11 2.835915e-10 1.114432e-10 ] [ 1.35541e-11 1.869398e-10 2.917972e-10 ] [ 1.620291e-10 3.348641e-11 1.837353e-10 ] [ 2.814436e-10 1.836887e-10 4.161362e-11 ] [ 2.451507e-10 2.913738e-10 2.050042e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.006173 0.8639589 3.9756389 ] [ -6.0172581 5.9425062 -1.6149374 ] [ 1.4559971 -3.233911 -5.6398408 ] [ 0.9984745 -3.5826558 5.4261434 ] [ 8.7985369 -0.0122595 -5.6243805 ] [ 0.7704226 0.0223611 3.4773763 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6229499610802e-09 1.384214750912085e-09 6.369675698323029e-09 ] [ -9.64071024913943e-09 9.520944502599051e-09 -2.587414946335538e-09 ] [ 2.3327645135726e-09 -5.181296597947949e-09 -9.036021074793968e-09 ] [ 1.59973250036497e-09 -5.74004736313352e-09 8.693640096588223e-09 ] [ 1.409681011842611e-08 -1.96418842826976e-11 -9.011250943583415e-09 ] [ 1.23435307785595e-09 3.582643163537088e-11 5.571371009584006e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.392939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.306003037040053e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3882646 0.8519772 0.3085414 ] [ 0.7068989 3.3257179 0.7634285 ] [ 0.1032874 1.7554657 2.6602158 ] [ 2.1025626 0.3028764 2.0939071 ] [ 2.7061781 1.8731241 0.1971187 ] [ 2.4211972 2.7766209 2.5487904 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.882646e-11 8.519772e-11 3.085414e-11 ] [ 7.068989e-11 3.3257179e-10 7.634285e-11 ] [ 1.032874e-11 1.7554657e-10 2.6602158e-10 ] [ 2.1025626e-10 3.028764e-11 2.0939071e-10 ] [ 2.7061781e-10 1.8731241e-10 1.971187e-11 ] [ 2.4211972e-10 2.7766209e-10 2.5487904e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.33e-05 5.32e-05 7.58e-05 ] [ 2.81e-05 -2.98e-05 1.7e-06 ] [ 4.42e-05 2.04e-05 -5.1e-05 ] [ 2e-06 2.45e-05 -2.47e-05 ] [ -9.53e-05 1.18e-05 7.84e-05 ] [ -6.23e-05 -8.01e-05 -8.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.3346131251264e-13 8.523579622656e-14 1.2144498785664e-13 ] [ 4.502116304448e-14 -4.774486329984001e-14 2.72370025536e-15 ] [ 7.081620663936001e-14 3.268440306432e-14 -8.17110076608e-14 ] [ 3.2043532416e-15 3.92533272096e-14 -3.957376253376001e-14 ] [ -1.5268743196224e-13 1.890568412544e-14 1.2561064707072e-13 ] [ -9.981560347584e-14 -1.2833434732608e-13 -1.2849456498816e-13 ] ] } "relaxed-potential-energy" { "source-value" -21.869792 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.503926944415888e-18 } }