{ "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" [ [ 0.5485971 0.5343947 2.664941 ] [ 1.37313 2.35631 1.443365 ] [ 2.145447 0.6526892 0.5854964 ] [ 2.929696 0.0722677 2.986283 ] [ 2.995983 2.738917 0.2990299 ] [ 2.823077 2.78342 2.858653 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.485971e-11 5.343947e-11 2.664941e-10 ] [ 1.37313e-10 2.35631e-10 1.443365e-10 ] [ 2.145447e-10 6.526892e-11 5.854964e-11 ] [ 2.929696e-10 7.22677e-12 2.986283e-10 ] [ 2.995983e-10 2.738917e-10 2.990299e-11 ] [ 2.823077e-10 2.78342e-10 2.858653e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4295919 -3.1649458 2.9414036 ] [ -12.2295661 6.9907633 3.543871 ] [ -0.0361517 -16.4965742 -2.3959809 ] [ 0.6539106 5.1978387 -1.1164596 ] [ 12.3782968 10.9584661 -18.6308767 ] [ 2.6631022 -3.4855481 15.6580426 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.494811961065052e-09 -5.070802166859152e-09 4.712648080256955e-09 ] [ -1.959392488794823e-08 1.120043752080666e-08 5.677907263331117e-09 ] [ -5.792140854217537e-11 -2.643042550653246e-08 -3.838784581863343e-09 ] [ 1.047680275413301e-09 8.327855643829466e-09 -1.78876546918772e-09 ] [ 1.983221773828345e-08 1.755739818524936e-08 -2.984995507374746e-08 ] [ 4.266760083641046e-09 -5.58446367649386e-09 2.508694978121045e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.704969 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.875342767898876e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4504234 0.3213786 2.5484554 ] [ 0.9582308 2.5471972 1.5428747 ] [ 2.1265514 0.4933317 0.6041952 ] [ 2.9522463 0.3045881 2.9911115 ] [ 3.2074002 2.7218307 0.3060069 ] [ 3.121078 2.7496724 2.8451246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.504234e-11 3.213786e-11 2.5484554e-10 ] [ 9.582308e-11 2.5471972e-10 1.5428747e-10 ] [ 2.1265514e-10 4.933317e-11 6.041952e-11 ] [ 2.9522463e-10 3.045881e-11 2.9911115e-10 ] [ 3.2074002e-10 2.7218307e-10 3.060069e-11 ] [ 3.121078e-10 2.7496724e-10 2.8451246e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.01e-05 1e-07 8.7e-06 ] [ -4.7e-05 -9.36e-05 3.1e-06 ] [ -3.02e-05 8.21e-05 -5.64e-05 ] [ -3.4e-06 5.33e-05 3.65e-05 ] [ 4.53e-05 -2.83e-05 -3.95e-05 ] [ 4.54e-05 -1.36e-05 4.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.618198387008e-14 1.6021766208e-16 1.393893660096e-14 ] [ -7.530230117759999e-14 -1.4996373170688e-13 4.96674752448e-15 ] [ -4.838573394816e-14 1.3153870056768e-13 -9.036276141312001e-14 ] [ -5.44740051072e-15 8.539601388864e-14 5.84794466592e-14 ] [ 7.257860092224001e-14 -4.534159836864e-14 -6.32859765216e-14 ] [ 7.273881858432e-14 -2.178960204288e-14 7.626360715008e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.960025 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.358166202638352e-18 } }