{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.1804539e-10 1.7835904e-10 7.446919e-11 ] [ 3.7395296e-10 1.2585882e-10 3.9412673e-10 ] [ 1.8615114e-10 1.3841257e-10 2.7995223e-10 ] [ 5.620601500000001e-10 2.2002744e-10 3.301491e-10 ] [ 3.9715346e-10 5.388329599999999e-10 1.5173128e-10 ] [ 5.572855e-10 3.932338e-10 1.9393731e-10 ] [ 2.2212809e-10 6.4713347e-10 2.3020006e-10 ] ] "source-value" [ [ 1.1804539 1.7835904 0.7446919 ] [ 3.7395296 1.2585882 3.9412673 ] [ 1.8615114 1.3841257 2.7995223 ] [ 5.6206015 2.2002744 3.301491 ] [ 3.9715346 5.3883296 1.5173128 ] [ 5.572855 3.932338 1.9393731 ] [ 2.2212809 6.4713347 2.3020006 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.15855328066887e-10 -5.438604561071808e-11 1.877808677935949e-10 ] [ -3.660468892892448e-10 -4.387656806658048e-10 2.180533541729626e-10 ] [ -2.444982406052391e-10 -1.831744497911328e-10 -2.13958671383184e-10 ] [ 5.778926101449178e-10 5.448743134728231e-10 -3.057145253680897e-10 ] [ 2.629218297854803e-10 -5.836505124847488e-11 3.324572564341728e-10 ] [ -4.298832134800896e-10 3.866569689038918e-10 1.152847789673261e-10 ] [ 4.154692315110624e-10 -1.968402152782464e-10 -3.339032208344448e-10 ] ] "source-value" [ [ -0.1347263 -0.0339451 0.1172036 ] [ -0.2284685 -0.273856 0.1360982 ] [ -0.1526038 -0.1143285 -0.1335425 ] [ 0.3606922 0.3400838 -0.190812 ] [ 0.1641029 -0.0364286 0.2075035 ] [ -0.268312 0.2413323 0.0719551 ] [ 0.2593155 -0.122858 -0.208406 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.55794659240215e-18 "source-value" -15.965447 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.642480959851079e-08 -3.481773327844762e-09 3.510400859487554e-09 ] [ 1.683650634495051e-08 -1.018372267316122e-08 -1.160603045497412e-08 ] [ -1.210298350550115e-08 1.872328448826269e-08 5.965631588294892e-09 ] [ -9.30540560441477e-09 -1.525190752429263e-09 4.952956628998802e-09 ] [ 6.565805188052289e-09 -1.293144772716778e-08 8.840165076613878e-09 ] [ -1.743755825793143e-08 9.369857164428e-09 -5.537615391231021e-09 ] [ -9.811737636662304e-10 2.899282791233472e-11 -6.125508146972324e-09 ] ] "source-value" [ [ 10.2515599 -2.173152 2.1910199 ] [ 10.5085208 -6.3561798 -7.2439145 ] [ -7.5540882 11.6861551 3.7234544 ] [ -5.8079774 -0.9519492 3.0913924 ] [ 4.0980533 -8.0711749 5.5175971 ] [ -10.8836679 5.8482049 -3.4563077 ] [ -0.6124005 0.0180959 -3.8232415 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.081097786434e-18 "source-value" -6.7476817 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] "source-value" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] } "instance-id" 1 }