{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.111705 1.964485 2.063826 ] [ 1.996516 4.229048 2.317605 ] [ 3.494235 2.652341 1.536538 ] [ 4.5932 4.863032 2.072185 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.111705e-10 1.964485e-10 2.063826e-10 ] [ 1.996516e-10 4.229048e-10 2.317605e-10 ] [ 3.494235e-10 2.652341e-10 1.536538e-10 ] [ 4.593200000000001e-10 4.863032e-10 2.072185e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2511794 0.5879826 0.2033968 ] [ -0.6275276 -0.3900828 0.0921307 ] [ 0.878707 -0.1978998 -0.2955276 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.024337656221395e-10 9.420519829185682e-10 3.258776003903712e-10 ] [ -1.005410057910098e-09 -6.249815474852951e-10 1.476096548140638e-10 ] [ 1.407843823532238e-09 -3.170704354332731e-10 -4.734874154220983e-10 ] [ 0.0 0.0 0.0 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2160482 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.754853913857759e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1831814 1.7681994 2.2942792 ] [ 1.6529754 3.5214461 2.1108432 ] [ 3.8929567 3.3905956 1.6279163 ] [ 5.4665425 5.0286649 1.9571153 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.831814e-11 1.7681994e-10 2.2942792e-10 ] [ 1.6529754e-10 3.5214461e-10 2.1108432e-10 ] [ 3.8929567e-10 3.3905956e-10 1.6279163e-10 ] [ 5.4665425e-10 5.0286649e-10 1.9571153e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.2e-06 -1e-07 -3e-07 ] [ -2.9e-06 -1.2e-06 -2e-07 ] [ -3.4e-06 -9e-07 6e-07 ] [ 5.1e-06 2.1e-06 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.9226119608e-15 -1.602176634e-16 -4.806529901999999e-16 ] [ -4.6463122386e-15 -1.9226119608e-15 -3.204353268e-16 ] [ -5.4474005556e-15 -1.4419589706e-15 9.613059803999998e-16 ] [ 8.1711008334e-15 3.364570931399999e-15 -3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -7.9978218 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.281392321085582e-18 } }