{ "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" [ [ 0.7742052 0.6824645 0.5764372 ] [ 0.6127639 2.971614 0.4436307 ] [ 0.405499 2.567939 2.589337 ] [ 2.552542 1.167694 2.901906 ] [ 2.397264 1.657583 0.5767519 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.742052e-11 6.824645e-11 5.764372e-11 ] [ 6.127639e-11 2.971614e-10 4.436307e-11 ] [ 4.05499e-11 2.567939e-10 2.589337e-10 ] [ 2.552542e-10 1.167694e-10 2.901906e-10 ] [ 2.397264e-10 1.657583e-10 5.767519e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.3712493 -8.9816463 1.2511026 ] [ -2.2802059 4.1618353 -3.5088506 ] [ 0.8318079 -1.5815768 2.2588308 ] [ -0.9848657 0.0374498 -0.2596269 ] [ 14.804513 6.363938 0.2585441 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.982092656184885e-08 -1.439018383671255e-08 2.004487352456648e-09 ] [ -3.65329261368894e-09 6.66799527221638e-09 -5.62179844351688e-09 ] [ 1.332703181356609e-09 -2.533965393836491e-09 3.619045927919527e-09 ] [ -1.577928812168054e-09 6.00011945079732e-11 -4.159681527378545e-10 ] [ 2.371944480634924e-08 1.019615276382469e-08 4.142333158785593e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4471221 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.513595828716501e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6474252 0.6044653 0.9470651 ] [ 0.3873661 2.8968415 0.0648578 ] [ 0.7640758 2.6285112 2.4911703 ] [ 2.3095376 0.7220785 2.7703717 ] [ 2.6338694 2.195398 0.8145979 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.474252000000001e-11 6.044653e-11 9.470651e-11 ] [ 3.873661e-11 2.8968415e-10 6.485779999999999e-12 ] [ 7.640758e-11 2.6285112e-10 2.4911703e-10 ] [ 2.3095376e-10 7.220785e-11 2.7703717e-10 ] [ 2.6338694e-10 2.195398e-10 8.145979e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.05e-05 5.4e-06 6.6e-06 ] [ 5.4e-06 -4.3e-06 -1.4e-06 ] [ -8.7e-06 -6.3e-06 -1.85e-05 ] [ 2.34e-05 -1.02e-05 4.8e-06 ] [ 1.04e-05 1.54e-05 8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.886638733699999e-14 8.6517538236e-15 1.05743657844e-14 ] [ 8.6517538236e-15 -6.8893595262e-15 -2.2430472876e-15 ] [ -1.39389367158e-14 -1.00937127942e-14 -2.9640267729e-14 ] [ 3.749093323559999e-14 -1.63422016668e-14 7.690447843199998e-15 ] [ 1.66626369936e-14 2.46735201636e-14 1.3618501389e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }