{ "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" [ [ 0.9561271 0.2009027 2.827783 ] [ 0.6408175 2.004915 2.928704 ] [ 2.494403 2.793601 0.1007886 ] [ 2.213716 1.735143 2.110523 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.561271000000001e-11 2.009027e-11 2.827783e-10 ] [ 6.408175e-11 2.004915e-10 2.928704e-10 ] [ 2.494403e-10 2.793601e-10 1.007886e-11 ] [ 2.213716e-10 1.735143e-10 2.110523e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.741777 -16.191757 -0.1747254 ] [ -15.6546062 15.5136844 7.2755886 ] [ -0.8746188 0.0998251 -1.2774626 ] [ 17.2710021 0.5782474 -5.8234006 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.188457767247162e-09 -2.594205451507475e-08 -2.799409509399283e-10 ] [ -2.508144406147073e-08 2.485566244814968e-08 1.1656777957479e-08 ] [ -1.401293793472151e-09 1.599374413890221e-10 -2.046720711666382e-09 ] [ 2.76711957824077e-08 9.264544653183859e-10 -9.330116294872693e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.8527644 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.96845580553054e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9810212 0.0506539 2.5216353 ] [ 0.3729309 2.2444964 3.2325762 ] [ 2.4491701 2.5753955 -0.0136434 ] [ 2.5019413 1.8640158 2.2272304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.810212000000001e-11 5.06539e-12 2.5216353e-10 ] [ 3.729309e-11 2.2444964e-10 3.2325762e-10 ] [ 2.4491701e-10 2.5753955e-10 -1.36434e-12 ] [ 2.5019413e-10 1.8640158e-10 2.2272304e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.01e-05 -5.68e-05 1.3e-05 ] [ -2.16e-05 4.47e-05 -2.8e-05 ] [ -2.81e-05 1.92e-05 2.73e-05 ] [ 5.98e-05 -7.1e-06 -1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.618198387008e-14 -9.100363206143999e-14 2.08282960704e-14 ] [ -3.460701500928e-14 7.161729494976001e-14 -4.48609453824e-14 ] [ -4.502116304448e-14 3.076179111936e-14 4.373942174784e-14 ] [ 9.581016192383999e-14 -1.137545400768e-14 -1.986699009792e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.8573457 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.419103220288341e-18 } }