{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.09862 0.3102875 1.608695 ] [ 0.216089 2.435481 0.8089597 ] [ 1.587261 0.9923217 0.3598848 ] [ 2.442881 2.780277 0.9615339 ] [ 1.769015 1.574471 2.844855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.862e-12 3.102875e-11 1.608695e-10 ] [ 2.16089e-11 2.435481e-10 8.089597e-11 ] [ 1.587261e-10 9.923217e-11 3.598848e-11 ] [ 2.442881e-10 2.780277e-10 9.615339e-11 ] [ 1.769015e-10 1.574471e-10 2.844855e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6694135 -3.6682618 4.5364867 ] [ -8.5600682 7.9778705 -0.2624717 ] [ 7.7541568 -9.6442157 -9.6182552 ] [ 4.4342761 5.7492324 1.4862004 ] [ 1.0410488 -0.4146253 3.8580397 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.481225142547901e-09 -5.877203294933725e-09 7.268252931310144e-09 ] [ -1.371474114249354e-08 1.278195759887001e-08 -4.205260213616313e-10 ] [ 1.242352873897734e-08 -1.545173692049231e-08 -1.541014361432803e-08 ] [ 7.104493497592203e-09 9.211285738825875e-09 2.381155534703608e-09 ] [ 1.667944048471895e-09 -6.643029620521862e-10 6.181261009458246e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5053475 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.522924553707973e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2267011 0.4912197 1.8086253 ] [ 0.0312204 2.5365837 0.5534854 ] [ 1.6456786 0.8214056 -0.1082998 ] [ 2.3462147 2.7258912 1.1875794 ] [ 1.8640513 1.517738 3.1425382 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.267011e-11 4.912197e-11 1.8086253e-10 ] [ 3.12204e-12 2.5365837e-10 5.534854000000001e-11 ] [ 1.6456786e-10 8.214056e-11 -1.082998e-11 ] [ 2.3462147e-10 2.7258912e-10 1.1875794e-10 ] [ 1.8640513e-10 1.517738e-10 3.1425382e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-07 -3.27e-05 2.54e-05 ] [ -1.44e-05 1.82e-05 -2.81e-05 ] [ -9.6e-06 2.7e-06 -8.9e-06 ] [ 2.62e-05 1e-05 1.38e-05 ] [ -1.3e-06 1.8e-06 -2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44195895872e-15 -5.239117550016001e-14 4.069528616832e-14 ] [ -2.307134333952e-14 2.915961449856e-14 -4.502116304448e-14 ] [ -1.538089555968e-14 4.32587687616e-15 -1.425937192512e-14 ] [ 4.197702746496e-14 1.6021766208e-14 2.211003736704e-14 ] [ -2.08282960704e-15 2.88391791744e-15 -3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.214602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.277430299837692e-18 } }