{ "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" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5604821 -1.0927711 0.5351624 ] [ -4.0900173 5.1453657 -1.2937261 ] [ -0.5879047 -0.1575561 0.7841796 ] [ 2.3500464 -3.5110062 -1.8943325 ] [ 2.8883577 -0.3840323 1.8687167 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.979913169968877e-10 -1.750812308305899e-09 8.574246856112179e-10 ] [ -6.55293009672754e-09 8.243784630006227e-09 -2.072777711138763e-09 ] [ -9.419271655984376e-10 -2.524326998844269e-10 1.256394221628296e-09 ] [ 3.765189399875205e-09 -5.625252049123849e-09 -3.035055243521616e-09 ] [ 4.62765917944766e-09 -6.152875726920517e-10 2.994014207638528e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.000731 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.922729064070981e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3330927 1.7275845 2.1897117 ] [ 2.6357084 4.2965245 0.9313131 ] [ 2.7955276 3.7888316 3.221078 ] [ 4.0914496 2.4547266 0.8092239 ] [ 5.0572177 3.3064308 2.7800887 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3330927e-10 1.7275845e-10 2.1897117e-10 ] [ 2.6357084e-10 4.296524500000001e-10 9.313131e-11 ] [ 2.7955276e-10 3.7888316e-10 3.221078e-10 ] [ 4.0914496e-10 2.4547266e-10 8.092239e-11 ] [ 5.0572177e-10 3.3064308e-10 2.7800887e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.14e-05 1.9e-06 1.62e-05 ] [ 1.36e-05 -1.71e-05 3.78e-05 ] [ 6.1e-06 4.2e-06 -7.47e-05 ] [ -3.52e-05 3.08e-05 5.1e-06 ] [ -1.59e-05 -1.98e-05 1.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.030834589312e-14 3.04413557952e-15 2.595526125696e-14 ] [ 2.178960204288e-14 -2.739722021568e-14 6.056227626623999e-14 ] [ 9.77327738688e-15 6.72914180736e-15 -1.1968259357376e-13 ] [ -5.639661705216e-14 4.934703992064001e-14 8.17110076608e-15 ] [ -2.547460827072e-14 -3.172309709184e-14 2.499395528448e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.191316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273699471358497e-18 } }