{ "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" [ [ 2.841627 2.849258 1.50686 ] [ 0.998489 4.149663 3.105849 ] [ 4.765797 1.647113 1.498592 ] [ 3.299037 1.906995 3.475865 ] [ 3.256514 4.175642 3.223298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.841627e-10 2.849258e-10 1.50686e-10 ] [ 9.98489e-11 4.149663e-10 3.105849e-10 ] [ 4.765797e-10 1.647113e-10 1.498592e-10 ] [ 3.299037e-10 1.906995e-10 3.475865e-10 ] [ 3.256514e-10 4.175642e-10 3.223298000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3172335 -0.1878727 -2.1041528 ] [ -0.3658741 0.0088486 -0.4277429 ] [ -0.2607788 -0.214194 0.8029279 ] [ 1.2083857 -1.4118839 0.1928645 ] [ 0.7355007 1.805102 1.5361033 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.110440717834557e-09 -3.010052476265722e-10 -3.371224422750858e-09 ] [ -5.861949291762412e-10 1.417702004681088e-11 -6.853196740931923e-10 ] [ -4.17813696560279e-10 -3.431766191156352e-10 1.28643230956804e-09 ] [ 1.936047317449043e-09 -2.262087375863926e-09 3.090029928822816e-10 ] [ 1.178402026122035e-09 2.892092222559322e-09 2.461108794393729e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.03673939923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.467569489716475e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6875678 2.8766062 1.7534771 ] [ 1.0588792 4.2625189 2.5555438 ] [ 4.4784899 1.5232585 1.3319042 ] [ 3.8705989 1.912268 3.509063 ] [ 3.0659282 4.1540194 3.6604759 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6875678e-10 2.8766062e-10 1.7534771e-10 ] [ 1.0588792e-10 4.2625189e-10 2.5555438e-10 ] [ 4.4784899e-10 1.5232585e-10 1.3319042e-10 ] [ 3.8705989e-10 1.912268e-10 3.509063e-10 ] [ 3.0659282e-10 4.1540194e-10 3.6604759e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-07 4.47e-05 -2.93e-05 ] [ -1.31e-05 -2.9e-06 1.58e-05 ] [ 2.03e-05 -6.84e-05 -6.1e-06 ] [ 1.69e-05 1.81e-05 -8.6e-06 ] [ -2.45e-05 8.5e-06 2.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883104e-16 7.161729494976001e-14 -4.694377498944e-14 ] [ -2.098851373248e-14 -4.646312200320001e-15 2.531439060864e-14 ] [ 3.252418540224e-14 -1.0958888086272e-13 -9.77327738688e-15 ] [ 2.707678489152e-14 2.899939683648e-14 -1.377871893888e-14 ] [ -3.92533272096e-14 1.36185012768e-14 4.518138070656001e-14 ] ] } "relaxed-potential-energy" { "source-value" -4.99599539923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.004467026278599e-19 } }