{ "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" [ [ -12.3438468 -5.0396703 -1.8454043 ] [ 1.4133421 1.1157309 -3.4373936 ] [ 11.5662249 6.4827917 7.3345423 ] [ -0.6357201 -2.5588524 -2.0517443 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.977702275369689e-08 -8.074441931200123e-09 -2.956663625383789e-09 ] [ 2.264423669812376e-09 1.787597963084143e-09 -5.507311662407546e-09 ] [ 1.853113512569482e-08 1.038657729925629e-08 1.175123219732866e-08 ] [ -1.018535881592638e-09 -4.09973349135797e-09 -3.287256749319662e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8661767 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.398651162221694e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7200586 -0.0782637 0.2306195 ] [ 1.119029 0.322997 2.5681848 ] [ 2.8090406 0.9367555 0.8553506 ] [ 2.489678 2.282829 2.8227076 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.200586e-11 -7.82637e-12 2.306195e-11 ] [ 1.119029e-10 3.22997e-11 2.5681848e-10 ] [ 2.8090406e-10 9.367555e-11 8.553506e-11 ] [ 2.489678e-10 2.282829e-10 2.8227076e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-06 6.4e-06 0.0 ] [ 8.1e-06 4e-07 1.3e-06 ] [ 3.1e-06 -4.2e-06 4.2e-06 ] [ -8.3e-06 -2.6e-06 -5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-15 1.025393037312e-14 0.0 ] [ 1.297763062848e-14 6.408706483200001e-16 2.08282960704e-15 ] [ 4.96674752448e-15 -6.72914180736e-15 6.72914180736e-15 ] [ -1.329806595264e-14 -4.16565921408e-15 -8.972189076479999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.347335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.657825822458557e-18 } }