{ "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" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1222578 -5.4735866 0.7874245 ] [ -4.544961 -4.9910174 2.6108883 ] [ -6.2132212 1.5012151 -0.615202 ] [ 1.88123 2.965221 -2.5917486 ] [ 6.7640955 3.463615 0.4172174 ] [ -2.2867888 2.7751609 -8.3299441 ] [ 4.2773876 -0.240608 7.7213644 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.958785904842452e-10 -8.769652554695503e-09 1.261593134939133e-09 ] [ -7.281830316641272e-09 -7.99649145816743e-09 4.183104228243982e-09 ] [ -9.95467782851344e-09 2.405211755827973e-09 -9.85662269590068e-10 ] [ 3.01406274917982e-09 4.750807800846114e-09 -4.152439048122211e-09 ] [ 1.083727576024454e-08 5.549323022171909e-09 6.684559695782316e-10 ] [ -3.663839582252899e-09 4.44629794957041e-09 -1.334604179954616e-08 ] [ 6.853130467281337e-09 -3.854965155534719e-10 1.237098962427943e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -20.202083 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.236730534072862e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0492564 2.3417593 2.1893657 ] [ 4.4302776 1.4661514 1.819333 ] [ 5.5269858 2.1597124 4.0304712 ] [ 3.2274797 1.3616945 4.0810266 ] [ 5.7699449 3.6329685 2.107552 ] [ 3.6205773 3.7455101 0.9697036 ] [ 3.6474143 3.8305062 3.5319159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0492564e-10 2.3417593e-10 2.1893657e-10 ] [ 4.4302776e-10 1.4661514e-10 1.819333e-10 ] [ 5.5269858e-10 2.1597124e-10 4.0304712e-10 ] [ 3.2274797e-10 1.3616945e-10 4.081026600000001e-10 ] [ 5.769944899999999e-10 3.6329685e-10 2.107552e-10 ] [ 3.6205773e-10 3.7455101e-10 9.697036e-11 ] [ 3.6474143e-10 3.8305062e-10 3.5319159e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.42e-05 4.75e-05 -2.98e-05 ] [ 2.82e-05 6.78e-05 -4.66e-05 ] [ 2.68e-05 5.7e-06 -2.47e-05 ] [ -4.04e-05 -5.66e-05 7.95e-05 ] [ -0.0001139 4.12e-05 5.81e-05 ] [ 5.36e-05 -9.86e-05 2.48e-05 ] [ 0.0001099 -7e-06 -6.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.028597399028e-13 7.6103390115e-14 -4.77448636932e-14 ] [ 4.51813810788e-14 1.086275757852e-13 -7.466143114439999e-14 ] [ 4.293833379119999e-14 9.1324068138e-15 -3.95737628598e-14 ] [ -6.472793601359999e-14 -9.06831974844e-14 1.27373042403e-13 ] [ -1.824879186126e-13 6.600967732079998e-14 9.308646243539999e-14 ] [ 8.587666758239999e-14 -1.579746161124e-13 3.97339805232e-14 ] [ 1.760792120766e-13 -1.1215236438e-14 -9.83736453276e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937497194045e-18 } }