{ "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" [ [ 1.250049 0.006506 1.072993 ] [ 1.196915 2.832702 0.8072165 ] [ 0.1797786 2.271145 2.71237 ] [ 2.446401 0.6534775 0.0239044 ] [ 1.500106 1.367345 2.855106 ] [ 2.614126 2.99563 2.902741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.250049e-10 6.506e-13 1.072993e-10 ] [ 1.196915e-10 2.832702e-10 8.072165e-11 ] [ 1.797786e-11 2.271145e-10 2.71237e-10 ] [ 2.446401e-10 6.534775e-11 2.39044e-12 ] [ 1.500106e-10 1.367345e-10 2.855106e-10 ] [ 2.614126e-10 2.99563e-10 2.902741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.9072681 -7.0325127 10.9770244 ] [ 1.3001305 -0.4992248 -0.8382255 ] [ -25.4531119 16.6740238 -2.0670863 ] [ 12.1918521 7.7814257 -10.9497248 ] [ 21.4483125 -22.374789 3.1102656 ] [ 3.4200849 5.451077 -0.2322534 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.067972318821763e-08 -1.126732743341908e-08 1.758713185963115e-08 ] [ 2.083038691089015e-09 -7.998463030835559e-10 -1.34298529905839e-09 ] [ -4.078038081278627e-08 2.671473110702278e-08 -3.311837343035975e-09 ] [ 1.953350039887139e-08 1.246721833303227e-08 -1.754339307875396e-08 ] [ 3.43639848431124e-08 -3.584836383113301e-08 4.983194828798485e-09 ] [ 5.479580067931106e-09 8.733588127580602e-09 -3.721109675813107e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.3650783 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.99362640022141e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0024954 -0.0430787 1.4868433 ] [ 1.2418446 3.2677644 0.860642 ] [ -0.2352179 1.9132666 2.1327814 ] [ 2.4796003 1.3114238 0.2147557 ] [ 1.6108015 1.1614407 3.4757037 ] [ 3.0878518 2.5159888 2.2036047 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0024954e-10 -4.30787e-12 1.4868433e-10 ] [ 1.2418446e-10 3.2677644e-10 8.60642e-11 ] [ -2.352179e-11 1.9132666e-10 2.1327814e-10 ] [ 2.4796003e-10 1.3114238e-10 2.147557e-11 ] [ 1.6108015e-10 1.1614407e-10 3.4757037e-10 ] [ 3.0878518e-10 2.5159888e-10 2.2036047e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.02e-05 3.26e-05 3.98e-05 ] [ 3.61e-05 -2.41e-05 3.97e-05 ] [ 2.41e-05 -3.8e-05 -2.54e-05 ] [ -5.05e-05 4.29e-05 1.77e-05 ] [ -4.55e-05 3.01e-05 -3.13e-05 ] [ -4.4e-06 -4.35e-05 -4.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.440750015616e-14 5.223095783807999e-14 6.376662950784e-14 ] [ 5.783857601088001e-14 -3.861245656128e-14 6.360641184576e-14 ] [ 3.861245656128e-14 -6.08827115904e-14 -4.069528616832e-14 ] [ -8.090991935040001e-14 6.873337703232e-14 2.835852618816e-14 ] [ -7.28990362464e-14 4.822551628608e-14 -5.014812823104e-14 ] [ -7.04957713152e-15 -6.969468300480001e-14 -6.488815314240001e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014482518531e-18 } }