{ "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" [ [ 2.596447 0.5894877 3.838334 ] [ 1.369077 2.86119 3.866131 ] [ 2.011058 5.105046 2.796353 ] [ 3.116098 2.834339 2.386368 ] [ 3.638135 2.33604 4.892399 ] [ 3.921466 4.7829 1.89112 ] [ 5.122204 3.316972 3.335617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.596447e-10 5.894877e-11 3.838334e-10 ] [ 1.369077e-10 2.86119e-10 3.866131e-10 ] [ 2.011058e-10 5.105046e-10 2.796353e-10 ] [ 3.116098e-10 2.834339e-10 2.386368e-10 ] [ 3.638135e-10 2.33604e-10 4.892399e-10 ] [ 3.921466e-10 4.7829e-10 1.89112e-10 ] [ 5.122204e-10 3.316972e-10 3.335617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9722379 -7.0492309 0.48092 ] [ -3.0581698 1.6422021 1.5774495 ] [ -2.322908 5.5380041 0.87306 ] [ 0.4499712 -6.0559405 -11.3514358 ] [ 3.7617958 2.8108375 5.6484883 ] [ -0.9463735 4.2174652 -0.7468839 ] [ 4.0879221 -1.1033376 3.5184019 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.159873480069228e-09 -1.129411303565079e-08 7.7051878682328e-10 ] [ -4.899728196364453e-09 2.631097832925731e-09 2.527352730214983e-09 ] [ -3.721708920531671e-09 8.8728607680162e-09 1.39879633208004e-09 ] [ 7.209333426129407e-10 -9.702686365994278e-09 -1.81870052011111e-08 ] [ 6.027061332639336e-09 4.503458164470974e-09 9.049875971682382e-09 ] [ -1.516257508736799e-09 6.757124198148137e-09 -1.196639932890792e-09 ] [ 6.549573270232211e-09 -1.767741722133638e-09 5.637101313201204e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.8811858 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.42292283709726e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.6629613 0.6641422 3.3323038 ] [ 1.3357496 3.3607012 3.8292375 ] [ 2.2780788 5.5912736 3.1021104 ] [ 2.3280316 2.2359606 1.8596933 ] [ 3.1923241 2.5298245 5.1172686 ] [ 3.9360726 4.0808074 1.9023297 ] [ 5.041267 3.3632652 3.8633788 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.6629613e-10 6.641422e-11 3.3323038e-10 ] [ 1.3357496e-10 3.3607012e-10 3.8292375e-10 ] [ 2.2780788e-10 5.5912736e-10 3.1021104e-10 ] [ 2.3280316e-10 2.2359606e-10 1.8596933e-10 ] [ 3.1923241e-10 2.5298245e-10 5.1172686e-10 ] [ 3.9360726e-10 4.0808074e-10 1.9023297e-10 ] [ 5.041267000000001e-10 3.3632652e-10 3.8633788e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.8e-06 5e-06 -8e-07 ] [ -3e-07 4e-06 -2.8e-06 ] [ 1.2e-06 -1.9e-06 7e-06 ] [ 6.1e-06 1e-06 1.8e-06 ] [ -1.23e-05 1.7e-06 1.3e-05 ] [ -3.3e-06 2e-07 -8.8e-06 ] [ -1.1e-06 -1.01e-05 -9.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.57013310132e-14 8.010883169999999e-15 -1.2817413072e-15 ] [ -4.806529901999999e-16 6.408706535999999e-15 -4.486094575199999e-15 ] [ 1.9226119608e-15 -3.0441356046e-15 1.1215236438e-14 ] [ 9.773277467399999e-15 1.602176634e-15 2.8839179412e-15 ] [ -1.97067725982e-14 2.7237002778e-15 2.082829624199999e-14 ] [ -5.2871828922e-15 3.204353268e-16 -1.40991543792e-14 ] [ -1.7623942974e-15 -1.61819840034e-14 -1.5220678023e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.891963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.026826168899254e-18 } }