{ "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" [ [ 0.5231689 0.1640524 1.493785 ] [ 2.625554 0.0718253 0.0473088 ] [ 2.391634 1.372958 2.83206 ] [ 1.806242 1.946446 0.9821647 ] [ 1.54049 2.8226 2.60214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.231689000000001e-11 1.640524e-11 1.493785e-10 ] [ 2.625554e-10 7.18253e-12 4.73088e-12 ] [ 2.391634e-10 1.372958e-10 2.83206e-10 ] [ 1.806242e-10 1.946446e-10 9.821647e-11 ] [ 1.54049e-10 2.8226e-10 2.60214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4416335 -3.064884 -0.2941695 ] [ 0.8906708 -1.4165038 -0.8606351 ] [ 9.8085324 -13.7263354 8.9336341 ] [ -0.2876095 0.6638073 -14.3647027 ] [ -7.9699602 17.5439159 6.585873 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.911928110262077e-09 -4.910485490263987e-09 -4.713114954524255e-10 ] [ 1.427011932589233e-09 -2.269489271634359e-09 -1.37888943625987e-09 ] [ 1.571500129563932e-08 -2.199201366713942e-08 1.431325969380165e-08 ] [ -4.608012168199777e-10 1.063536536776372e-09 -2.301479083068264e-08 ] [ -1.276928390114649e-08 2.810845189226139e-08 1.055173174815796e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.26588346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.25992263469412e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.30245 0.3166693 1.7006012 ] [ 3.1539376 0.6733704 0.6698233 ] [ 2.327291 0.5752932 2.870299 ] [ 1.2275436 1.9758754 0.3126951 ] [ 1.8758667 2.8366734 2.40404 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0245e-11 3.166693e-11 1.7006012e-10 ] [ 3.1539376e-10 6.733704000000001e-11 6.698233e-11 ] [ 2.327291e-10 5.752932e-11 2.870299e-10 ] [ 1.2275436e-10 1.9758754e-10 3.126951e-11 ] [ 1.8758667e-10 2.8366734e-10 2.404040000000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.2e-05 3.44e-05 1.88e-05 ] [ -1.53e-05 2.3e-05 2.24e-05 ] [ -1.87e-05 -1.5e-06 -3.55e-05 ] [ 8.7e-06 -1.98e-05 9.3e-06 ] [ -6.6e-06 -3.62e-05 -1.49e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.12696518656e-14 5.511487575552001e-14 3.012092047104e-14 ] [ -2.451330229824e-14 3.68500622784e-14 3.588875630592e-14 ] [ -2.996070280896e-14 -2.4032649312e-15 -5.68772700384e-14 ] [ 1.393893660096e-14 -3.172309709184e-14 1.490024257344e-14 ] [ -1.057436569728e-14 -5.799879367296e-14 -2.387243164992e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }