{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5537382 -3.7527355 -9.567963 ] [ -1.0463716 -0.0430244 2.9104745 ] [ -7.9026555 -8.0120902 1.3375105 ] [ -5.4833716 3.3701016 -1.0077928 ] [ 7.9380602 -6.4126635 6.7223702 ] [ 3.4703769 6.8611593 -5.8525903 ] [ 4.5776997 7.9892527 5.4579909 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.489363018883874e-09 -6.012545082146199e-09 -1.532956662727943e-08 ] [ -1.676472114189089e-09 -6.893268780394752e-11 4.66309419933457e-09 ] [ -1.266144988433654e-08 -1.28367836021808e-08 2.142928053174519e-09 ] [ -8.78532978067869e-09 5.399497993240673e-09 -1.61466206277057e-09 ] [ 1.271817446694297e-08 -1.02742195367575e-08 1.077042437080262e-08 ] [ 5.56015673454438e-09 1.099278902204449e-08 -9.37688334978086e-09 ] [ 7.334283436383174e-09 1.280019389360328e-08 8.744665416519152e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4471239 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.727254563180918e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.531694 1.7416026 1.3591094 ] [ 1.4727008 2.8792304 4.4961365 ] [ 2.0749195 0.8926195 3.4181021 ] [ 0.9677747 4.2703337 2.7346465 ] [ 4.244265 1.2331441 4.1055036 ] [ 3.0830865 3.8747126 1.9201149 ] [ 3.8029846 3.4910681 4.1123751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.531694e-10 1.7416026e-10 1.3591094e-10 ] [ 1.4727008e-10 2.8792304e-10 4.4961365e-10 ] [ 2.0749195e-10 8.926195e-11 3.4181021e-10 ] [ 9.677747e-11 4.2703337e-10 2.7346465e-10 ] [ 4.244265000000001e-10 1.2331441e-10 4.1055036e-10 ] [ 3.0830865e-10 3.8747126e-10 1.9201149e-10 ] [ 3.8029846e-10 3.4910681e-10 4.1123751e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.99e-05 7.9e-06 -1.43e-05 ] [ 1.2e-06 -2.1e-06 3.49e-05 ] [ 7.1e-06 3e-07 1.37e-05 ] [ -1.84e-05 2.66e-05 -5e-07 ] [ -2.58e-05 -1.3e-06 -7.7e-06 ] [ -2.17e-05 -1.53e-05 -2.83e-05 ] [ 7.8e-06 -1.62e-05 2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.994861337792e-14 1.265719530432e-14 -2.291112567744e-14 ] [ 1.92261194496e-15 -3.36457090368e-15 5.591596406592e-14 ] [ 1.137545400768e-14 4.8065298624e-16 2.194981970496e-14 ] [ -2.948004982272e-14 4.261789811328e-14 -8.010883104e-16 ] [ -4.133615681664e-14 -2.08282960704e-15 -1.233675998016e-14 ] [ -3.476723267136e-14 -2.451330229824e-14 -4.534159836864e-14 ] [ 1.249697764224e-14 -2.595526125696e-14 3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }