{ "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" [ [ 0.7872548 2.971705 2.821442 ] [ 1.838331 0.4014098 1.675971 ] [ 2.974058 1.714847 0.8061894 ] [ 1.598524 2.494897 0.1079685 ] [ 2.930835 1.52262 2.533969 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.872548000000001e-11 2.971705e-10 2.821442e-10 ] [ 1.838331e-10 4.014098e-11 1.675971e-10 ] [ 2.974058e-10 1.714847e-10 8.061894e-11 ] [ 1.598524e-10 2.494897e-10 1.079685e-11 ] [ 2.930835e-10 1.52262e-10 2.533969e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.9568988 9.0023051 8.2572605 ] [ -21.1228545 -43.4086029 4.01847 ] [ 36.4996159 2.4974076 -30.3632179 ] [ -27.798438 27.0908878 -32.7358929 ] [ 20.3785754 4.8180024 50.8233804 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.274835723143158e-08 1.44232827645286e-08 1.322958972495532e-08 ] [ -3.384254364446007e-08 -6.954824870797108e-08 6.438298685386176e-09 ] [ 5.847883126315995e-08 4.001288069328238e-09 -4.864723785163607e-08 ] [ -4.453800745835831e-08 4.340438706987595e-08 -5.244868226539272e-08 ] [ 3.265007707109001e-08 7.719290804238291e-09 8.142803186690495e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 29.470125 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.72163452870536e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8027732 2.9772681 2.383972 ] [ 1.7939639 -0.8012482 2.5662121 ] [ 3.3650056 1.9764349 0.3058483 ] [ 1.5217657 3.5621764 0.1291397 ] [ 2.6454944 1.3908476 2.5603679 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.027732e-11 2.9772681e-10 2.383972e-10 ] [ 1.7939639e-10 -8.012482e-11 2.5662121e-10 ] [ 3.3650056e-10 1.9764349e-10 3.058483e-11 ] [ 1.5217657e-10 3.5621764e-10 1.291397e-11 ] [ 2.6454944e-10 1.3908476e-10 2.5603679e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-06 3.7e-06 0.0 ] [ 1.64e-05 -7.6e-06 5.6e-06 ] [ -7e-07 -1.26e-05 -7.6e-06 ] [ 2.8e-06 2.27e-05 -5e-06 ] [ -1.55e-05 -6.2e-06 6.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-15 5.928053496960001e-15 0.0 ] [ 2.627569658112e-14 -1.217654231808e-14 8.972189076479999e-15 ] [ -1.12152363456e-15 -2.018742542208e-14 -1.217654231808e-14 ] [ 4.48609453824e-15 3.636940929216e-14 -8.010883104e-15 ] [ -2.48337376224e-14 -9.93349504896e-15 1.105501868352e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.419499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.669387769824898e-18 } }