{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.426259 1.696941 2.248909 ] [ 1.360678 2.530518 4.32015 ] [ 2.124458 3.992448 3.096339 ] [ 3.479806 2.793816 1.249034 ] [ 3.515691 1.341825 3.018021 ] [ 4.217135 3.723991 3.061085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.426259e-10 1.696941e-10 2.248909e-10 ] [ 1.360678e-10 2.530518e-10 4.32015e-10 ] [ 2.124458e-10 3.992448e-10 3.096339e-10 ] [ 3.479806e-10 2.793816e-10 1.249034e-10 ] [ 3.515691e-10 1.341825e-10 3.018021e-10 ] [ 4.217135e-10 3.723991e-10 3.061085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4925707 -3.3202435 -4.1891271 ] [ -3.1773541 -3.8666876 6.9750482 ] [ -2.656542 9.217874 -1.6697987 ] [ 0.2079263 -0.4733696 -8.485549 ] [ 3.1967103 -4.2864021 3.5330355 ] [ 6.9218302 2.7288288 3.836391 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.197891742831091e-09 -5.319616511063165e-09 -6.711721501179705e-09 ] [ -5.090682455023026e-09 -6.195116472657262e-09 1.117525915499312e-08 ] [ -4.256249484573274e-09 1.476866221628018e-08 -2.675312438582233e-09 ] [ 3.331346567094471e-10 -7.584217061174477e-10 -1.359534822245282e-08 ] [ 5.121694506130555e-09 -6.867573231968024e-09 5.660546878556438e-09 ] [ 1.108999451958739e-08 4.37206570552572e-09 6.146575968447532e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.4489133 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.353665136042618e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3935572 1.3292908 1.8428674 ] [ 1.2564211 2.4759776 4.0752604 ] [ 2.2813129 4.6046776 4.001073 ] [ 3.4982199 2.3413013 0.9074957 ] [ 3.5244089 1.4513259 3.3864962 ] [ 4.170107 3.8769657 2.7803453 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3935572e-10 1.3292908e-10 1.8428674e-10 ] [ 1.2564211e-10 2.4759776e-10 4.0752604e-10 ] [ 2.2813129e-10 4.6046776e-10 4.001073e-10 ] [ 3.4982199e-10 2.3413013e-10 9.074957000000001e-11 ] [ 3.5244089e-10 1.4513259e-10 3.3864962e-10 ] [ 4.170107e-10 3.8769657e-10 2.7803453e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.4e-06 2e-05 3.23e-05 ] [ 1.44e-05 -2.6e-05 -1.05e-05 ] [ 1.31e-05 -5.8e-06 -1.81e-05 ] [ 1.76e-05 5e-06 -6.3e-06 ] [ -2.43e-05 2.36e-05 -6.8e-06 ] [ -2.42e-05 -1.67e-05 9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.44740051072e-15 3.2043532416e-14 5.175030485184e-14 ] [ 2.307134333952e-14 -4.16565921408e-14 -1.68228545184e-14 ] [ 2.098851373248e-14 -9.292624400640001e-15 -2.899939683648e-14 ] [ 2.819830852608e-14 8.010883104e-15 -1.009371271104e-14 ] [ -3.893289188544e-14 3.781136825088e-14 -1.089480102144e-14 ] [ -3.877267422336e-14 -2.675634956736e-14 1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.060752 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.252780812526684e-18 } }