{ "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" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2732869 -1.2975912 -2.7729475 ] [ -1.6597993 2.0186401 -0.8494131 ] [ 0.7212702 -1.0056763 4.0911982 ] [ -2.6084201 1.8307818 -3.4690788 ] [ -0.4490411 1.8558135 -0.6480948 ] [ 1.3390184 -0.2150026 1.1635265 ] [ 1.383685 -3.1869654 2.4848095 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.040030502750908e-09 -2.078970283995817e-09 -4.442751655205808e-09 ] [ -2.659291633680205e-09 3.234217974029374e-09 -1.360909810221253e-09 ] [ 1.15560225171974e-09 -1.611271055952647e-09 6.554822107099043e-09 ] [ -4.179149701444799e-09 2.933235797746141e-09 -5.55807694907292e-09 ] [ -7.194431521983149e-10 2.973341002265021e-09 -1.038362336622052e-09 ] [ 2.145343975301023e-09 -3.444721391312141e-10 1.864174955981251e-09 ] [ 2.216907757551648e-09 -5.10608145517852e-09 3.981103688041737e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.307318085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.170761419745321e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.701031 1.8763337 1.1504275 ] [ 0.5837466 2.674826 1.7137237 ] [ 1.7909714 1.8551868 3.5326761 ] [ 2.323361 4.0724201 2.3906913 ] [ 3.9685076 1.1480966 2.9932054 ] [ 4.466921 3.2238038 1.924133 ] [ 3.6149612 3.204002 4.154297 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.701031e-10 1.8763337e-10 1.1504275e-10 ] [ 5.837466e-11 2.674826e-10 1.7137237e-10 ] [ 1.7909714e-10 1.8551868e-10 3.5326761e-10 ] [ 2.323361e-10 4.0724201e-10 2.3906913e-10 ] [ 3.9685076e-10 1.1480966e-10 2.9932054e-10 ] [ 4.466921e-10 3.2238038e-10 1.924133e-10 ] [ 3.6149612e-10 3.204002e-10 4.154297e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.45e-05 -1.27e-05 4.9e-06 ] [ -1.81e-05 2.8e-05 -4.2e-06 ] [ -3.3e-06 -1.99e-05 -2.75e-05 ] [ -1.19e-05 -1.6e-05 5e-06 ] [ 2.22e-05 2.91e-05 8.1e-06 ] [ 6.4e-06 -1.97e-05 1.85e-05 ] [ 1.9e-05 1.13e-05 -5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.32315610016e-14 -2.034764308416e-14 7.850665441919999e-15 ] [ -2.899939683648e-14 4.48609453824e-14 -6.72914180736e-15 ] [ -5.28718284864e-15 -3.188331475392e-14 -4.4059857072e-14 ] [ -1.906590178752e-14 -2.56348259328e-14 8.010883104e-15 ] [ 3.556832098176e-14 4.662333966527999e-14 1.297763062848e-14 ] [ 1.025393037312e-14 -3.156287942976e-14 2.96402674848e-14 ] [ 3.04413557952e-14 1.810459581504e-14 -8.010883104e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.660528085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.547787224328598e-18 } }