{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2609343 1.090408 2.782185 ] [ 0.9561081 2.831858 1.606096 ] [ 1.573969 0.2926919 1.087299 ] [ 2.9831 1.515461 0.0011433 ] [ 2.828068 2.074027 2.745594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.609343e-11 1.090408e-10 2.782185e-10 ] [ 9.561081000000001e-11 2.831858e-10 1.606096e-10 ] [ 1.573969e-10 2.926919e-11 1.087299e-10 ] [ 2.9831e-10 1.515461e-10 1.1433e-13 ] [ 2.828068e-10 2.074027e-10 2.745594e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.849561 -1.0306527 1.4790176 ] [ -0.4369796 2.4909072 -0.8808056 ] [ -0.8407686 -3.342368 -0.7526171 ] [ 1.1184154 1.2028684 -0.2630865 ] [ 2.0088937 0.6792451 0.4174916 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.963323417357674e-09 -1.651287673709012e-09 2.369647439994758e-09 ] [ -7.001185046546664e-10 3.990873313302365e-09 -1.41120615141635e-09 ] [ -1.347059805520892e-09 -5.355063911829312e-09 -1.205825531968841e-09 ] [ 1.791899020985763e-09 1.927207644256965e-09 -4.21511043020841e-10 ] [ 3.218602546329805e-09 1.088270627978993e-09 6.688952864112744e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.056974432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.61130494447908e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6771674 1.2690655 2.7952937 ] [ 0.75155 2.9633547 1.1217661 ] [ 1.4040765 -0.0501157 0.9491581 ] [ 2.7637059 1.8527136 0.4936347 ] [ 3.0056796 1.7694278 2.8624646 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.771674e-11 1.2690655e-10 2.795293700000001e-10 ] [ 7.515500000000001e-11 2.9633547e-10 1.1217661e-10 ] [ 1.4040765e-10 -5.01157e-12 9.491581e-11 ] [ 2.7637059e-10 1.8527136e-10 4.936347e-11 ] [ 3.0056796e-10 1.7694278e-10 2.8624646e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.1e-06 -1.12e-05 -2e-07 ] [ -1.97e-05 3.18e-05 -1.03e-05 ] [ 1.1e-05 -1.5e-06 9.7e-06 ] [ 1.3e-06 -9e-06 -8.4e-06 ] [ 1.24e-05 -1.01e-05 9.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.1711008334e-15 -1.79443783008e-14 -3.204353268e-16 ] [ -3.15628796898e-14 5.09492169612e-14 -1.65024193302e-14 ] [ 1.7623942974e-14 -2.403264951e-15 1.55411133498e-14 ] [ 2.0828296242e-15 -1.4419589706e-14 -1.34582837256e-14 ] [ 1.98669902616e-14 -1.61819840034e-14 1.49002426962e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }