{ "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" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0315838 -0.8645486 -1.6938759 ] [ -1.5797084 -0.6277129 -7.6274729 ] [ -7.6238277 11.9747942 -7.8958171 ] [ -6.7367614 -7.7099435 7.4834386 ] [ 13.1971601 -14.1286708 -2.7556503 ] [ -2.564263 3.3844734 16.5734889 ] [ 9.3389842 7.9716083 -4.0841114 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.459309309156024e-09 -1.385159554465371e-09 -2.713888365516559e-09 ] [ -2.530971866161374e-09 -1.005706932954568e-09 -1.222055875616558e-08 ] [ -1.221471850194744e-08 1.918573530613144e-08 -1.265049355973286e-08 ] [ -1.079348161498788e-08 -1.235269122338892e-08 1.198979036811228e-08 ] [ 2.114418137317459e-08 -2.263662603873963e-08 -4.415038485760506e-09 ] [ -4.108402228182471e-09 5.422524155199487e-09 2.655365644066831e-08 ] [ 1.496270214726059e-08 1.277192444843523e-08 -6.543467801822757e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.6286801 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.813786420582206e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.5373693 1.1567457 2.2629873 ] [ 1.785444 0.8463828 2.0666322 ] [ 2.8661515 2.9761572 1.9357103 ] [ 2.6482504 -0.0252597 4.116069 ] [ 5.0265732 0.6484852 3.7532048 ] [ 2.4255548 2.0728849 5.4540485 ] [ 4.1793995 2.99217 3.9305779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.373693e-11 1.1567457e-10 2.2629873e-10 ] [ 1.785444e-10 8.463828000000001e-11 2.0666322e-10 ] [ 2.8661515e-10 2.9761572e-10 1.9357103e-10 ] [ 2.6482504e-10 -2.52597e-12 4.116069e-10 ] [ 5.0265732e-10 6.484852e-11 3.7532048e-10 ] [ 2.4255548e-10 2.0728849e-10 5.4540485e-10 ] [ 4.1793995e-10 2.992170000000001e-10 3.9305779e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.31e-05 1.26e-05 7.6e-06 ] [ -1.36e-05 -5.56e-05 -3.92e-05 ] [ 9.6e-06 -1.98e-05 3.55e-05 ] [ 4.08e-05 7.33e-05 -3.87e-05 ] [ -1.66e-05 1.4e-05 1.22e-05 ] [ 1.33e-05 1.41e-05 3.1e-06 ] [ -1.05e-05 -3.84e-05 1.95e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.701027994048e-14 2.018742542208e-14 1.217654231808e-14 ] [ -2.178960204288e-14 -8.908102011648e-14 -6.280532353535999e-14 ] [ 1.538089555968e-14 -3.172309709184e-14 5.68772700384e-14 ] [ 6.536880612864e-14 1.1743954630464e-13 -6.200423522496e-14 ] [ -2.659613190528e-14 2.24304726912e-14 1.954655477376e-14 ] [ 2.130894905664e-14 2.259069035328e-14 4.96674752448e-15 ] [ -1.68228545184e-14 -6.152358223872e-14 3.12424441056e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.33691 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.617461525811373e-18 } }