{ "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" [ [ 2.273702 2.402034 1.908702 ] [ 1.908149 2.590409 4.360855 ] [ 2.360817 4.517724 2.766871 ] [ 3.26801 0.6931896 3.511788 ] [ 4.292326 2.985376 3.423625 ] [ 4.772846 4.542174 1.540942 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.273702e-10 2.402034e-10 1.908702e-10 ] [ 1.908149e-10 2.590409e-10 4.360855e-10 ] [ 2.360817e-10 4.517724e-10 2.766871e-10 ] [ 3.26801e-10 6.931896e-11 3.511788e-10 ] [ 4.292326e-10 2.985376e-10 3.423625e-10 ] [ 4.772846e-10 4.542174e-10 1.540942e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7965974 -0.7997166 1.7821402 ] [ 1.689845 0.1110233 -2.125556 ] [ 1.7515901 -1.0445144 0.267026 ] [ -0.7029499 2.2644824 -0.4855239 ] [ -2.0133501 -0.0039594 -0.6405212 ] [ -1.5217325 -0.5273153 1.202435 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.276289730470066e-09 -1.281287239785665e-09 2.855303363427836e-09 ] [ 2.707430151775776e-09 1.778789356240647e-10 -3.405516129401165e-09 ] [ 2.806356707444734e-09 -1.673496551768939e-09 4.278228143457408e-10 ] [ -1.126249895373698e-09 3.628100759493074e-09 -7.778950414196371e-10 ] [ -3.225742459705342e-09 -6.34365811239552e-12 -1.026228091766761e-09 ] [ -2.438084234611536e-09 -8.448522454501384e-10 1.926513245031648e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.16978 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.551990320427942e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.17768 2.5524388 1.7192121 ] [ 1.9980566 2.6051537 4.1025837 ] [ 2.6058053 4.5514599 2.958624 ] [ 3.5155364 1.1903714 3.0891141 ] [ 4.3060586 3.2162655 3.9793651 ] [ 4.2727131 3.6152172 1.663884 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.17768e-10 2.5524388e-10 1.7192121e-10 ] [ 1.9980566e-10 2.6051537e-10 4.102583700000001e-10 ] [ 2.6058053e-10 4.551459900000001e-10 2.958624e-10 ] [ 3.5155364e-10 1.1903714e-10 3.0891141e-10 ] [ 4.3060586e-10 3.2162655e-10 3.9793651e-10 ] [ 4.2727131e-10 3.6152172e-10 1.663884e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.9e-06 1.67e-05 -1.08e-05 ] [ -1.45e-05 7.4e-06 2.81e-05 ] [ 9.8e-06 -8.7e-06 -7.1e-06 ] [ 2.3e-05 -2.4e-05 -1.41e-05 ] [ -1.24e-05 1.75e-05 -8.5e-06 ] [ 2e-06 -9e-06 1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.265719530432e-14 2.675634956736e-14 -1.730350750464e-14 ] [ -2.32315610016e-14 1.185610699392e-14 4.502116304448e-14 ] [ 1.570133088384e-14 -1.393893660096e-14 -1.137545400768e-14 ] [ 3.68500622784e-14 -3.84522388992e-14 -2.259069035328e-14 ] [ -1.986699009792e-14 2.8038090864e-14 -1.36185012768e-14 ] [ 3.2043532416e-15 -1.44195895872e-14 1.986699009792e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.223076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.201399929266158e-18 } }