{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0221122 0.00357 0.1110342 ] [ 0.2725629 2.182164 0.260904 ] [ 0.3472204 2.881652 2.59775 ] [ 1.734388 0.2655593 2.566686 ] [ 2.338795 2.363947 0.0295877 ] [ 1.600298 1.908592 1.497057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.21122e-12 3.57e-13 1.110342e-11 ] [ 2.725629e-11 2.182164e-10 2.60904e-11 ] [ 3.472204e-11 2.881652e-10 2.59775e-10 ] [ 1.734388e-10 2.655593e-11 2.566686e-10 ] [ 2.338795e-10 2.363947e-10 2.95877e-12 ] [ 1.600298e-10 1.908592e-10 1.497057e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2529813 -1.2529937 0.9293374 ] [ -21.6730487 2.4835106 -14.2818638 ] [ -7.1753421 6.5593299 7.4138705 ] [ -0.0584912 -7.8126616 2.8723063 ] [ 20.2252142 8.8010907 -26.7984619 ] [ 8.4286866 -8.7782759 29.8648116 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.053207243595911e-10 -2.007517212149689e-09 1.488962655115058e-09 ] [ -3.472405192859983e-08 3.97902262082898e-09 -2.288206828180985e-08 ] [ -1.149616535886198e-08 1.05092050138944e-08 1.187832998473881e-08 ] [ -9.371323316253696e-11 -1.251726376174192e-08 4.601942001636551e-09 ] [ 3.240436534191217e-08 1.410090175708031e-08 -4.293586912957955e-08 ] [ 1.350424461457024e-08 -1.406434841791208e-08 4.784870293011664e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.13876392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.223243084345616e-20 } "relaxed-configuration-positions" { "source-value" [ [ -0.0191531 -0.0153544 0.5457089 ] [ -0.0352363 2.2238742 0.0253706 ] [ 0.1476117 2.9747318 2.2250193 ] [ 1.6382475 -0.1160201 2.1092029 ] [ 2.2825662 2.4563197 -0.0716992 ] [ 2.3013404 2.0819331 2.2294164 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.91531e-12 -1.53544e-12 5.457089000000001e-11 ] [ -3.52363e-12 2.2238742e-10 2.53706e-12 ] [ 1.476117e-11 2.9747318e-10 2.2250193e-10 ] [ 1.6382475e-10 -1.160201e-11 2.1092029e-10 ] [ 2.2825662e-10 2.4563197e-10 -7.169920000000001e-12 ] [ 2.3013404e-10 2.0819331e-10 2.2294164e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.06e-05 6.9e-06 3.59e-05 ] [ -9.3e-06 -8.8e-06 2.5e-06 ] [ -1.04e-05 2.11e-05 -4.7e-05 ] [ 8.6e-06 -5.24e-05 -2.96e-05 ] [ 2.4e-06 2.97e-05 -6.3e-06 ] [ 1.92e-05 3.5e-06 4.45e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.698307218048e-14 1.105501868352e-14 5.751814068672e-14 ] [ -1.490024257344e-14 -1.409915426304e-14 4.005441552e-15 ] [ -1.666263685632e-14 3.380592669888e-14 -7.530230117759999e-14 ] [ 1.377871893888e-14 -8.395405492992e-14 -4.742442797568e-14 ] [ 3.84522388992e-15 4.758464563776e-14 -1.009371271104e-14 ] [ 3.076179111936e-14 5.6076181728e-15 7.129685962560001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.486326 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961835932168718e-18 } }