{ "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" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4838818 -1.9586509 -1.1767259 ] [ -2.883923 -2.9455213 0.6850467 ] [ -0.8562218 0.1669896 -1.0066988 ] [ -0.7181181 -0.1316629 2.6031917 ] [ 1.2565637 -1.0288389 -1.7404348 ] [ 2.4678005 3.168459 -1.2689921 ] [ 2.2177805 2.7292254 1.9046132 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.377440727990621e-09 -3.138104680288879e-09 -1.885322726069839e-09 ] [ -4.620554006787398e-09 -4.719245362928423e-09 1.097565806896191e-09 ] [ -1.371818550179294e-09 2.675468330367437e-10 -1.612909281547415e-09 ] [ -1.150552030793317e-09 -2.109472202067283e-10 4.170772881200608e-09 ] [ 2.013236982685945e-09 -1.648381632149589e-09 -2.788483946586724e-09 ] [ 3.953852265898551e-09 5.076430933763347e-09 -2.033149474599896e-09 ] [ 3.553276067166134e-09 4.372701128773528e-09 3.051526740707074e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.3692 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.782852616199936e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0143932 1.9707225 1.486897 ] [ 2.7211433 1.4396675 3.8256665 ] [ 1.7166159 4.3232963 2.019581 ] [ 1.9135538 3.7421572 4.3712872 ] [ 4.4747065 2.0943378 1.914597 ] [ 4.1334621 4.5709294 1.9519909 ] [ 4.3950503 3.4936423 4.1930563 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0143932e-10 1.9707225e-10 1.486897e-10 ] [ 2.7211433e-10 1.4396675e-10 3.8256665e-10 ] [ 1.7166159e-10 4.3232963e-10 2.019581e-10 ] [ 1.9135538e-10 3.7421572e-10 4.371287200000001e-10 ] [ 4.4747065e-10 2.0943378e-10 1.914597e-10 ] [ 4.1334621e-10 4.5709294e-10 1.9519909e-10 ] [ 4.395050300000001e-10 3.4936423e-10 4.1930563e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.09e-05 -1.32e-05 -9.6e-06 ] [ -1.26e-05 -1.72e-05 1e-05 ] [ -6.7e-06 1.47e-05 -7.2e-06 ] [ -1.05e-05 8e-07 1.02e-05 ] [ 1.65e-05 -8e-06 -1.33e-05 ] [ 3.5e-06 1.26e-05 -8.5e-06 ] [ 2.07e-05 1.03e-05 1.84e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.746372516672e-14 -2.114873139456e-14 -1.538089555968e-14 ] [ -2.018742542208e-14 -2.755743787776e-14 1.6021766208e-14 ] [ -1.073458335936e-14 2.355199632576e-14 -1.153567166976e-14 ] [ -1.68228545184e-14 1.28174129664e-15 1.634220153216e-14 ] [ 2.64359142432e-14 -1.28174129664e-14 -2.130894905664e-14 ] [ 5.6076181728e-15 2.018742542208e-14 -1.36185012768e-14 ] [ 3.316505605055999e-14 1.650241919424e-14 2.948004982272e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }