{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1477317 -1.6654633 -1.3988695 ] [ 0.1883155 -2.2652911 0.1254873 ] [ 1.7712218 0.9761794 0.0714695 ] [ -1.9092824 -0.0301989 2.2944087 ] [ 2.4310768 -2.1998381 -8.0865947 ] [ 1.9411797 5.8477475 0.7347454 ] [ 0.7252203 -0.6631354 6.2593533 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.247575447841097e-09 -2.668366384044532e-09 -2.241236026915263e-09 ] [ 3.01714693920027e-10 -3.629396469628157e-09 2.010528199237482e-10 ] [ 2.837810181591421e-09 1.56401182527214e-09 1.14506762943663e-10 ] [ -3.059007648987441e-09 -4.83839719525026e-11 3.676048007986316e-09 ] [ 3.89501444441949e-09 -3.524529202402955e-09 -1.295615307696824e-08 ] [ 3.110112757735129e-09 9.369124406031913e-09 1.177191911818984e-09 ] [ 1.16193101916247e-09 -1.062460043058244e-09 1.002858960121079e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -18.639755 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.986417992448467e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5965327 3.0419187 2.3943677 ] [ 2.6386684 1.9506057 1.7436406 ] [ 2.2160085 2.40049 4.1050567 ] [ 1.5312877 4.7887641 3.7783762 ] [ 4.2976771 3.6157363 1.6825034 ] [ 3.2220861 5.6771625 2.2976131 ] [ 3.9329004 4.1237127 4.0417842 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.965327000000001e-11 3.0419187e-10 2.3943677e-10 ] [ 2.6386684e-10 1.9506057e-10 1.7436406e-10 ] [ 2.2160085e-10 2.40049e-10 4.1050567e-10 ] [ 1.5312877e-10 4.7887641e-10 3.7783762e-10 ] [ 4.2976771e-10 3.6157363e-10 1.6825034e-10 ] [ 3.2220861e-10 5.6771625e-10 2.2976131e-10 ] [ 3.9329004e-10 4.1237127e-10 4.0417842e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.73e-05 5.4e-06 8.7e-06 ] [ -4.5e-06 6.5e-06 7.2e-06 ] [ 5.8e-06 -5.3e-06 -1.1e-05 ] [ -1.33e-05 7.2e-06 -8.7e-06 ] [ -8.4e-06 7.5e-06 -8.9e-06 ] [ 8.2e-06 -2.97e-05 9.9e-06 ] [ -5.2e-06 8.3e-06 2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.77176557682e-14 8.6517538236e-15 1.39389367158e-14 ] [ -7.209794853e-15 1.0414148121e-14 1.15356717648e-14 ] [ 9.2926244772e-15 -8.4915361602e-15 -1.7623942974e-14 ] [ -2.13089492322e-14 1.15356717648e-14 -1.39389367158e-14 ] [ -1.34582837256e-14 1.2016324755e-14 -1.42593720426e-14 ] [ 1.31378483988e-14 -4.75846460298e-14 1.58615486766e-14 ] [ -8.331318496799998e-15 1.32980660622e-14 4.3258769118e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.475251 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.600932199548513e-18 } }