{ "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" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -54.1268435 -12.7988406 -5.6885781 ] [ 1.3322294 0.0921238 -2.0945427 ] [ 2.9637029 1.7382087 -13.4857415 ] [ -13.3506865 -6.0579419 25.0559366 ] [ 52.9686496 13.918517 9.2780636 ] [ 10.2129482 3.107933 -13.0651379 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.672076392787476e-08 -2.050600335161054e-08 -9.114106912504115e-09 ] [ 2.134466815807839e-09 1.475985997952892e-10 -3.355827372855272e-09 ] [ 4.748375536498038e-09 2.784917364155515e-09 -2.160653992346411e-08 ] [ -2.139015795815924e-08 -9.705892962309563e-09 4.01440361635054e-08 ] [ 8.486513272365344e-08 2.229992271733177e-08 1.486509670868592e-08 ] [ 1.636294697029236e-08 4.979457632637522e-09 -2.093265866336783e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.8982268 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.041294624992591e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3168448 0.523222 -0.103934 ] [ 0.4327876 0.325722 2.0819532 ] [ 0.1389617 2.3328341 0.8638279 ] [ 1.5945184 2.2829747 2.7286398 ] [ 2.7723995 0.4733613 1.7608829 ] [ 2.4785749 2.4804716 0.5427524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3168448e-10 5.23222e-11 -1.03934e-11 ] [ 4.327876e-11 3.25722e-11 2.0819532e-10 ] [ 1.389617e-11 2.3328341e-10 8.638279e-11 ] [ 1.5945184e-10 2.2829747e-10 2.7286398e-10 ] [ 2.7723995e-10 4.733613e-11 1.7608829e-10 ] [ 2.4785749e-10 2.4804716e-10 5.427524e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.63e-05 -1.42e-05 1.74e-05 ] [ 1.72e-05 4.1e-06 -1.44e-05 ] [ 3.26e-05 -1.29e-05 -1.66e-05 ] [ 7.8e-06 7e-06 6.6e-06 ] [ -2.27e-05 6.6e-06 -1.81e-05 ] [ -1.86e-05 9.4e-06 2.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.61154791342e-14 -2.27509082028e-14 2.78778734316e-14 ] [ 2.75574381048e-14 6.568924199399999e-15 -2.30713435296e-14 ] [ 5.22309582684e-14 -2.06680785786e-14 -2.65961321244e-14 ] [ 1.24969777452e-14 1.1215236438e-14 1.05743657844e-14 ] [ -3.636940959179999e-14 1.05743657844e-14 -2.899939707539999e-14 ] [ -2.98004853924e-14 1.50604603596e-14 4.02146335134e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.519951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.248964582702493e-18 } }