{ "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" [ [ 0.3126518 0.5217928 0.1846885 ] [ 0.8333114 2.588069 2.680495 ] [ 2.642381 0.0430457 2.992394 ] [ 2.45603 2.243401 1.184533 ] [ 2.245972 1.834771 2.762862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.126518e-11 5.217928e-11 1.846885e-11 ] [ 8.333114000000001e-11 2.588069e-10 2.680495e-10 ] [ 2.642381e-10 4.30457e-12 2.992394e-10 ] [ 2.45603e-10 2.243401e-10 1.184533e-10 ] [ 2.245972e-10 1.834771e-10 2.762862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.796499 1.439348 0.8190317 ] [ -38.5797301 18.4124282 0.5915742 ] [ 2.7280639 -19.6343284 5.5452176 ] [ 5.0365935 11.0722821 -40.7327659 ] [ 29.0185737 -11.2897299 33.7769425 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.878308720804366e-09 2.306089733794632e-09 1.312233452245298e-09 ] [ -6.181154211224648e-08 2.949996223724268e-08 9.478063605172428e-10 ] [ 4.370840236638912e-09 -3.145766218676261e-08 8.884418069165557e-09 ] [ 8.069512420656279e-09 1.773975166567645e-08 -6.526108576317197e-08 ] [ 4.649288073414692e-08 -1.808814144995115e-08 5.411662804146153e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.237075 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.800377899950555e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8835074 0.4579718 0.0535392 ] [ 0.6312978 2.85899 2.8484181 ] [ 2.4119606 -0.3584382 3.1906889 ] [ 1.7683766 2.410512 0.8024253 ] [ 2.7952037 1.8620438 2.9099011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.835074000000001e-11 4.579718e-11 5.353920000000001e-12 ] [ 6.312978000000001e-11 2.85899e-10 2.8484181e-10 ] [ 2.4119606e-10 -3.584382e-11 3.1906889e-10 ] [ 1.7683766e-10 2.410512e-10 8.024253e-11 ] [ 2.7952037e-10 1.8620438e-10 2.9099011e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-05 -5e-06 7.1e-06 ] [ -2.11e-05 -2e-06 9.7e-06 ] [ -5.4e-06 4.67e-05 -3.85e-05 ] [ 1.78e-05 -2.26e-05 -1.85e-05 ] [ 2.16e-05 -1.72e-05 4.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.082829624199999e-14 -8.010883169999999e-15 1.13754541014e-14 ] [ -3.38059269774e-14 -3.204353268e-15 1.55411133498e-14 ] [ -8.6517538236e-15 7.482164880779999e-14 -6.168380040899999e-14 ] [ 2.851874408519999e-14 -3.62091919284e-14 -2.9640267729e-14 ] [ 3.46070152944e-14 -2.75574381048e-14 6.456771835019998e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.996903 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.92211576669645e-18 } }