{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.248369 0.1750326 1.959235 ] [ 0.2041437 1.690187 0.8451771 ] [ 0.5672117 2.337944 2.235934 ] [ 2.305261 0.0188332 0.1900716 ] [ 2.629759 0.4646214 2.471997 ] [ 1.518408 2.931316 1.102854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.248369e-10 1.750326e-11 1.959235e-10 ] [ 2.041437e-11 1.690187e-10 8.451771e-11 ] [ 5.672117e-11 2.337944e-10 2.235934e-10 ] [ 2.305261e-10 1.88332e-12 1.900716e-11 ] [ 2.629759e-10 4.646214e-11 2.471997e-10 ] [ 1.518408e-10 2.931316e-10 1.102854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -46.897674 -12.2773607 -12.5962963 ] [ -20.8026081 -24.5215413 -37.6298806 ] [ -11.6841155 3.344619 57.9503426 ] [ 1.0685636 0.422971 -3.3353193 ] [ 46.8683799 9.5364072 18.0344848 ] [ 31.4474542 23.4949048 -22.423331 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.513835747174931e-08 -1.967050044072988e-08 -2.018149160680065e-08 ] [ -3.332945262407913e-08 -3.928784050052597e-08 -6.02897154375299e-08 ] [ -1.872001684305723e-08 5.358670411432445e-09 9.28466848460148e-08 ] [ 1.712027631862922e-09 6.776742530596139e-10 -5.343770649389236e-09 ] [ 7.509142314921525e-08 1.527900878814936e-08 2.889443015278816e-08 ] [ 5.038437631802515e-08 3.764298748861444e-08 -3.592613698464785e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.18617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.112657346595178e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7211586 -0.1890801 2.0397132 ] [ 0.0528039 1.5167277 0.455701 ] [ 0.6328626 2.1321154 2.7251679 ] [ 2.1915312 0.4071965 0.2099271 ] [ 2.7715868 1.0225714 2.479382 ] [ 2.1032093 2.7284033 0.8953775 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.211586000000001e-11 -1.890801e-11 2.0397132e-10 ] [ 5.28039e-12 1.5167277e-10 4.55701e-11 ] [ 6.328626000000001e-11 2.1321154e-10 2.7251679e-10 ] [ 2.1915312e-10 4.071965e-11 2.099271e-11 ] [ 2.7715868e-10 1.0225714e-10 2.479382e-10 ] [ 2.1032093e-10 2.7284033e-10 8.953775e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.76e-05 -1.23e-05 7e-07 ] [ -5.8e-06 3.23e-05 -8.2e-06 ] [ -8.6e-06 2.03e-05 1.28e-05 ] [ -4.3e-06 -1.27e-05 -2.43e-05 ] [ -2.81e-05 1.68e-05 7.3e-06 ] [ -9e-07 -4.44e-05 1.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.62636077784e-14 -1.97067725982e-14 1.1215236438e-15 ] [ -9.2926244772e-15 5.17503052782e-14 -1.31378483988e-14 ] [ -1.37787190524e-14 3.252418567019999e-14 2.05078609152e-14 ] [ -6.8893595262e-15 -2.03476432518e-14 -3.893289220619999e-14 ] [ -4.50211634154e-14 2.691656745119999e-14 1.16958894282e-14 ] [ -1.4419589706e-15 -7.11366425496e-14 1.87454666178e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.290227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.770199769595592e-18 } }