{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2842494 -0.9028072 -0.9602694 ] [ -2.2200831 -3.3160364 2.2674927 ] [ -2.8115653 0.3073446 -0.7848054 ] [ 0.0293011 4.0573572 3.6659733 ] [ 1.9130577 0.1174448 0.978397 ] [ 1.5543995 1.5056591 -0.170941 ] [ 1.8191395 -1.7689621 -4.9958471 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.554177431564275e-10 -1.44645658892991e-09 -1.538521182349644e-09 ] [ -3.556965239053189e-09 -5.312875993801798e-09 3.632923791774668e-09 ] [ -4.504624191512538e-09 4.924203326491278e-10 -1.257396863757592e-09 ] [ 4.694553738372288e-11 6.50060284807455e-09 5.873536713737025e-09 ] [ 3.06505632118142e-09 1.881673127945318e-10 1.567564799260858e-09 ] [ 2.490422538283209e-09 2.412331808914769e-09 -2.738776737361728e-10 ] [ 2.914582776873802e-09 -2.834189719701272e-09 -8.004229424711479e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.405917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.468300003938528e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6983999 1.3302699 1.727168 ] [ 1.5084165 2.740304 3.2065962 ] [ 1.1276215 4.6572458 1.8737005 ] [ 3.1780157 3.3520938 4.7668627 ] [ 5.1681004 3.4784164 3.4134617 ] [ 3.1177112 4.7835715 0.5203033 ] [ 4.3813258 2.9226633 1.2528131 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6983999e-10 1.3302699e-10 1.727168e-10 ] [ 1.5084165e-10 2.740304e-10 3.2065962e-10 ] [ 1.1276215e-10 4.657245800000001e-10 1.8737005e-10 ] [ 3.1780157e-10 3.3520938e-10 4.7668627e-10 ] [ 5.168100400000001e-10 3.4784164e-10 3.4134617e-10 ] [ 3.1177112e-10 4.7835715e-10 5.203033e-11 ] [ 4.3813258e-10 2.9226633e-10 1.2528131e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 2.67e-05 -1.27e-05 ] [ 1.1e-05 2.34e-05 -6.1e-06 ] [ -1.79e-05 -1.05e-05 5.3e-06 ] [ -1.79e-05 -5.3e-06 -1.3e-06 ] [ 2.57e-05 -8.1e-06 -8.1e-06 ] [ -1.3e-05 -2.17e-05 3.2e-06 ] [ 1.21e-05 -4.4e-06 1.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 4.277811577536e-14 -2.034764308416e-14 ] [ 1.76239428288e-14 3.749093292672001e-14 -9.77327738688e-15 ] [ -2.867896151232001e-14 -1.68228545184e-14 8.491536090240001e-15 ] [ -2.867896151232001e-14 -8.491536090240001e-15 -2.08282960704e-15 ] [ 4.117593915456e-14 -1.297763062848e-14 -1.297763062848e-14 ] [ -2.08282960704e-14 -3.476723267136e-14 5.126965186560001e-15 ] [ 1.938633711168e-14 -7.04957713152e-15 3.156287942976e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }