{ "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" [ [ -33.4608027 -4.4521785 -3.0595901 ] [ 32.6409111 1.9689245 1.4887841 ] [ -5.3785734 3.2684105 0.3883414 ] [ -0.4074007 -0.485193 0.4509903 ] [ 1.1818478 -18.9862051 -2.9949868 ] [ -6.3419032 2.6124404 10.0260022 ] [ 11.765921 16.0738012 -6.2995412 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.361011624082411e-08 -7.133176363097168e-09 -4.902003767837722e-09 ] [ 5.229650507689123e-08 3.154564828010132e-09 2.385295098090719e-09 ] [ -8.617424625733935e-09 5.236570933420257e-09 6.221915170948475e-10 ] [ -6.527278822152438e-10 -7.773648875803618e-10 7.225661208206501e-10 ] [ 1.893528930104305e-09 -3.041925417955163e-08 -4.798497870098431e-09 ] [ -1.016084912212983e-08 4.185590966597613e-09 1.60634264572726e-08 ] [ 1.885108370368991e-08 2.575306870220116e-08 -1.009297771556032e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.772424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.527020919434082e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5014875 0.3410295 0.7273125 ] [ 1.400391 1.2087198 2.8889061 ] [ 2.3179042 3.5674221 3.2380897 ] [ 2.0236846 0.0311968 5.1529471 ] [ 3.8941717 0.4129094 3.2016367 ] [ 3.4227351 2.2540023 5.2815379 ] [ 4.8336299 2.8522862 3.0288 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.014875e-11 3.410295e-11 7.273125e-11 ] [ 1.400391e-10 1.2087198e-10 2.8889061e-10 ] [ 2.3179042e-10 3.5674221e-10 3.2380897e-10 ] [ 2.0236846e-10 3.11968e-12 5.1529471e-10 ] [ 3.8941717e-10 4.129094e-11 3.2016367e-10 ] [ 3.4227351e-10 2.2540023e-10 5.2815379e-10 ] [ 4.833629900000001e-10 2.8522862e-10 3.0288e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.26e-05 2.97e-05 6.1e-05 ] [ 5e-06 -6e-06 -0.0001159 ] [ -4.79e-05 4.63e-05 -4.78e-05 ] [ 6.41e-05 2.08e-05 8.21e-05 ] [ -6.2e-05 -1.19e-05 -3.32e-05 ] [ 2.39e-05 -5.56e-05 -1.15e-05 ] [ -2.57e-05 -2.34e-05 6.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.82527246084e-14 4.75846460298e-14 9.773277467399998e-14 ] [ 8.010883169999999e-15 -9.613059803999999e-15 -1.856922718806e-13 ] [ -7.674426076859999e-14 7.41807781542e-14 -7.65840431052e-14 ] [ 1.026995222394e-13 3.332527398719999e-14 1.315387016514e-13 ] [ -9.933495130799999e-14 -1.90659019446e-14 -5.31922642488e-14 ] [ 3.82920215526e-14 -8.908102085039999e-14 -1.8425031291e-14 ] [ -4.11759394938e-14 -3.749093323559999e-14 1.044619165368e-13 ] ] } "relaxed-potential-energy" { "source-value" -23.725785 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.801289835030768e-18 } }