{ "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" [ [ 0.9651302 0.0332184 0.096045 ] [ 1.129779 0.3019077 2.825054 ] [ 2.558191 0.7044327 0.6108776 ] [ 2.484706 2.424759 2.944886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.651302000000001e-11 3.32184e-12 9.604500000000001e-12 ] [ 1.129779e-10 3.019077e-11 2.825054e-10 ] [ 2.558191e-10 7.044327e-11 6.108776e-11 ] [ 2.484706e-10 2.424759e-10 2.944886e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.8957635 -6.5117223 -3.4793769 ] [ 1.0895751 1.0222359 -2.3560848 ] [ 15.4917792 7.3680631 7.0285764 ] [ -0.6855908 -1.8785767 -1.1931147 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.546782085929006e-08 -1.043292931615674e-08 -5.574576370059354e-09 ] [ 1.745691766208213e-09 1.637802473415961e-09 -3.774864014282562e-09 ] [ 2.482056665332721e-08 1.18049385366576e-08 1.126102087836384e-08 ] [ -1.098437560245367e-09 -3.009811693916827e-09 -1.91158049402192e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8008739 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.294024619360452e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7481648 -0.0788339 0.2592786 ] [ 1.1047867 0.343851 2.5593292 ] [ 2.7922062 0.956256 0.8479903 ] [ 2.4926485 2.2430447 2.8102645 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.481648e-11 -7.88339e-12 2.592786e-11 ] [ 1.1047867e-10 3.438510000000001e-11 2.5593292e-10 ] [ 2.7922062e-10 9.56256e-11 8.479903e-11 ] [ 2.4926485e-10 2.2430447e-10 2.8102645e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.27e-05 5.33e-05 1e-06 ] [ 1.42e-05 -4.44e-05 8e-06 ] [ -2.71e-05 -4.47e-05 1.53e-05 ] [ -9.7e-06 3.58e-05 -2.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.636940959179999e-14 8.53960145922e-14 1.602176634e-15 ] [ 2.27509082028e-14 -7.11366425496e-14 1.2817413072e-14 ] [ -4.34189867814e-14 -7.16172955398e-14 2.45133025002e-14 ] [ -1.55411133498e-14 5.735792349719999e-14 -3.877267454279999e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.547084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689829154163525e-18 } }