{ "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" [ [ 0.5147912 0.3967754 -0.0266551 ] [ 0.0111899 0.3185007 0.1161463 ] [ 0.3064271 -0.0289008 -0.0392204 ] [ -0.8324082 -0.6863753 -0.0502708 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.24786425233577e-10 6.357042695885683e-10 -4.270617804508608e-11 ] [ 1.792819616908992e-11 5.102943752484347e-10 1.86086886452423e-10 ] [ 4.909503355995437e-10 -4.630418608241664e-11 -6.283800793842433e-11 ] [ -1.333664957002211e-09 -1.099694458754586e-09 -8.054270046891264e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -3.198630620327121 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.124771198463115e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5368869 2.3419405 1.986906 ] [ 1.7755712 4.6116765 2.5636805 ] [ 3.8222569 2.2427765 1.4313966 ] [ 4.0609411 4.5125125 2.0081709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5368869e-10 2.3419405e-10 1.986906e-10 ] [ 1.7755712e-10 4.6116765e-10 2.5636805e-10 ] [ 3.8222569e-10 2.2427765e-10 1.4313966e-10 ] [ 4.0609411e-10 4.5125125e-10 2.0081709e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -3e-07 -1e-07 ] [ -1.3e-06 1.1e-06 6e-07 ] [ 6e-07 -1.3e-06 -5e-07 ] [ 7e-07 5e-07 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 -4.8065298624e-16 -1.6021766208e-16 ] [ -2.08282960704e-15 1.76239428288e-15 9.6130597248e-16 ] [ 9.6130597248e-16 -2.08282960704e-15 -8.010883104e-16 ] [ 1.12152363456e-15 8.010883104e-16 0.0 ] ] } "relaxed-potential-energy" { "source-value" -3.86421462032712 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.19115432244166e-19 } }