{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7931521 0.6999537 -1.0258036 ] [ -1.2800521 -0.9672724 0.016024 ] [ -0.8512542 0.5207575 -0.2898105 ] [ 0.0784271 1.2849545 2.3855978 ] [ 2.8460312 -1.5383933 -1.0860077 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.270769751358424e-09 1.121449453782457e-09 -1.643518545452475e-09 ] [ -2.050869548025944e-09 -1.549741225225106e-09 2.56732781716992e-11 ] [ -1.363859577597807e-09 8.34345491606256e-10 -4.643276075623585e-10 ] [ 1.256540660571437e-10 2.058724058691753e-09 3.822149021791914e-09 ] [ 4.559844650707369e-09 -2.464777778855361e-09 -1.73997614694878e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8306302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.094387601177043e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8602777 3.081137 1.0058997 ] [ 1.7668386 1.0978582 1.5283415 ] [ 1.9466406 4.6657581 2.162171 ] [ 3.5243965 3.6618058 3.3994781 ] [ 3.4138907 1.4568189 3.0070249 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.602777e-11 3.081137e-10 1.0058997e-10 ] [ 1.7668386e-10 1.0978582e-10 1.5283415e-10 ] [ 1.9466406e-10 4.6657581e-10 2.162171e-10 ] [ 3.5243965e-10 3.6618058e-10 3.3994781e-10 ] [ 3.4138907e-10 1.4568189e-10 3.0070249e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.5e-06 -4.02e-05 -3.1e-06 ] [ -5.27e-05 3.74e-05 -7.63e-05 ] [ -2.67e-05 2.64e-05 7.2e-06 ] [ 3.1e-05 -5.8e-05 -2.96e-05 ] [ 5.19e-05 3.44e-05 0.0001018 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.6076181728e-15 -6.440750015616e-14 -4.96674752448e-15 ] [ -8.443470791616e-14 5.992140561792e-14 -1.2224607616704e-13 ] [ -4.277811577536e-14 4.229746278912e-14 1.153567166976e-14 ] [ 4.96674752448e-14 -9.29262440064e-14 -4.742442797568e-14 ] [ 8.315296661952001e-14 5.511487575552001e-14 1.6310157999744e-13 ] ] } "relaxed-potential-energy" { "source-value" -8.9680601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.436841622614931e-18 } }