{ "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" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0518525 -1.1793621 -1.8244446 ] [ -3.7982171 -0.5819691 1.3953235 ] [ -12.5645166 1.8883625 -0.2312513 ] [ 2.8100535 -7.9121604 -4.998674 ] [ 1.7350698 -2.332799 2.984227 ] [ 9.3654536 4.3564844 -2.8462362 ] [ 2.5040093 5.7614437 5.5210556 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.3076863230032e-11 -1.889546384077592e-09 -2.923082484064808e-09 ] [ -6.085414638342775e-09 -9.324172860480173e-10 2.235554690152828e-09 ] [ -2.013057474817351e-08 3.02549024909544e-09 -3.70505426389607e-10 ] [ 4.502202020897213e-09 -1.267667841289958e-08 -8.00875861780082e-09 ] [ 2.779888269016132e-09 -3.73755601882562e-09 4.781258730560122e-09 ] [ 1.50051108011072e-08 6.979857454559915e-09 -4.560173096914633e-09 ] [ 4.011865158725773e-09 9.23085039819545e-09 8.845706204456918e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.61528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.021190668084583e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4803663 0.3984073 1.2665627 ] [ 0.919786 1.7792123 3.3102921 ] [ 1.1391052 3.9764549 2.1527371 ] [ 3.7921879 1.2502825 1.8402675 ] [ 3.1971862 1.5114211 4.2158047 ] [ 3.5962307 3.7078499 1.8266856 ] [ 4.1602897 3.8494927 4.2882873 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4803663e-10 3.984073e-11 1.2665627e-10 ] [ 9.197860000000001e-11 1.7792123e-10 3.3102921e-10 ] [ 1.1391052e-10 3.9764549e-10 2.1527371e-10 ] [ 3.7921879e-10 1.2502825e-10 1.8402675e-10 ] [ 3.1971862e-10 1.5114211e-10 4.2158047e-10 ] [ 3.5962307e-10 3.7078499e-10 1.8266856e-10 ] [ 4.1602897e-10 3.8494927e-10 4.2882873e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.68e-05 -2.84e-05 1.25e-05 ] [ -2.62e-05 2.28e-05 -1.29e-05 ] [ 1.08e-05 -9.8e-06 -6.5e-06 ] [ -9.9e-06 2.21e-05 -4.1e-06 ] [ 4.59e-05 -1.87e-05 7.4e-06 ] [ 2.37e-05 2.32e-05 1.16e-05 ] [ -2.76e-05 -1.12e-05 -8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.691656722944e-14 -4.550181603071999e-14 2.002720776e-14 ] [ -4.197702746496e-14 3.652962695424e-14 -2.066807840832e-14 ] [ 1.730350750464e-14 -1.570133088384e-14 -1.04141480352e-14 ] [ -1.586154854592e-14 3.540810331968e-14 -6.568924145279999e-15 ] [ 7.353990689472e-14 -2.996070280896e-14 1.185610699392e-14 ] [ 3.797158591296e-14 3.717049760256e-14 1.858524880128e-14 ] [ -4.422007473408001e-14 -1.794437815296e-14 -1.28174129664e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735010429801e-18 } }