{ "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" [ [ 2.905521 1.741541 1.432593 ] [ 2.475113 5.398899 1.710867 ] [ 1.47054 3.340259 2.516001 ] [ 3.027539 3.458512 0.3041981 ] [ 3.800453 3.660633 2.737021 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.905521e-10 1.741541e-10 1.432593e-10 ] [ 2.475113e-10 5.398899000000001e-10 1.710867e-10 ] [ 1.47054e-10 3.340259e-10 2.516001e-10 ] [ 3.027539e-10 3.458512e-10 3.041981e-11 ] [ 3.800453e-10 3.660633e-10 2.737021e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1231066 -6.1902868 3.7661872 ] [ -0.1533075 0.7786951 -0.1514515 ] [ -1.5870246 -0.1609599 -0.2273055 ] [ 0.2125181 5.7543553 -3.6120459 ] [ 1.6509207 -0.1818037 0.2246157 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.972385180111844e-10 -9.917932868718632e-09 6.034097131109885e-09 ] [ -2.45625694316955e-10 1.247607094230293e-09 -2.42652054484251e-10 ] [ -2.542693731703196e-09 -2.578861907909765e-10 -3.641835608796869e-10 ] [ 3.404915341220754e-10 9.21949360539406e-09 -5.7871355419155e-09 ] [ 2.645066570126923e-09 -2.912816401147458e-10 3.598740261695538e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.979121 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.079484439605871e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.969147 1.551214 1.6651717 ] [ 2.5025134 5.4887225 1.8151027 ] [ 1.3867441 3.3388153 2.2987153 ] [ 2.9244136 3.5978056 0.2830012 ] [ 3.8963477 3.6232866 2.6386892 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.969147e-10 1.551214e-10 1.6651717e-10 ] [ 2.5025134e-10 5.4887225e-10 1.8151027e-10 ] [ 1.3867441e-10 3.3388153e-10 2.2987153e-10 ] [ 2.9244136e-10 3.5978056e-10 2.830012e-11 ] [ 3.8963477e-10 3.6232866e-10 2.6386892e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.81e-05 4.22e-05 -1.59e-05 ] [ 0.0 -3.19e-05 1.45e-05 ] [ 1.38e-05 3.27e-05 -7e-07 ] [ -1.23e-05 -3.66e-05 -1.09e-05 ] [ -1.95e-05 -6.3e-06 1.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.899939707539999e-14 6.761185395480001e-14 -2.54746084806e-14 ] [ 0.0 -5.11094346246e-14 2.3231561193e-14 ] [ 2.21100375492e-14 5.23911759318e-14 -1.1215236438e-15 ] [ -1.97067725982e-14 -5.86396648044e-14 -1.74637253106e-14 ] [ -3.1242444363e-14 -1.00937127942e-14 2.082829624199999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }