{ "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" [ [ 1.1028 0.2583089 1.436622 ] [ 0.0542075 1.282802 2.764068 ] [ 0.3917807 2.567162 0.7355983 ] [ 2.495357 1.268739 0.0869323 ] [ 2.96001 0.2024969 2.578704 ] [ 2.541972 2.542294 2.28683 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1028e-10 2.583089e-11 1.436622e-10 ] [ 5.42075e-12 1.282802e-10 2.764068e-10 ] [ 3.917807e-11 2.567162e-10 7.355983000000001e-11 ] [ 2.495357e-10 1.268739e-10 8.693230000000001e-12 ] [ 2.96001e-10 2.024969e-11 2.578704e-10 ] [ 2.541972e-10 2.542294e-10 2.28683e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3019498 -4.669898 -3.4893676 ] [ -2.4438019 3.0386007 3.5394815 ] [ 0.7400699 0.0287388 0.1356277 ] [ 0.9357859 1.3490609 -0.7477912 ] [ 1.4989359 0.1201758 0.8651267 ] [ -0.4290401 0.1333217 -0.3030771 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.837769102152359e-10 -7.482001397120678e-09 -5.590583190097006e-09 ] [ -3.915402270046619e-09 4.868375001486514e-09 5.670874509054115e-09 ] [ 1.185722691537794e-09 4.604463346984704e-11 2.172995300728762e-10 ] [ 1.499294291054287e-09 2.161433834015407e-09 -1.198093577879977e-09 ] [ 2.401560055057807e-09 1.925428571459367e-10 1.386085772769856e-09 ] [ -6.873980176056941e-10 2.136049107853113e-10 -4.855830439198636e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.47764 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.960444281555891e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.801717 -0.0754316 1.0333354 ] [ 0.5007156 1.3700356 3.0098028 ] [ 0.4813243 2.3539835 0.7475307 ] [ 2.6813249 1.3372316 0.2864508 ] [ 2.7007184 0.3532845 2.5487199 ] [ 2.3803269 2.7826991 2.2629149 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.01717e-11 -7.54316e-12 1.0333354e-10 ] [ 5.007156e-11 1.3700356e-10 3.0098028e-10 ] [ 4.813243e-11 2.3539835e-10 7.475307e-11 ] [ 2.6813249e-10 1.3372316e-10 2.864508e-11 ] [ 2.7007184e-10 3.532845e-11 2.5487199e-10 ] [ 2.3803269e-10 2.7826991e-10 2.2629149e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.1e-06 6.8e-06 1.31e-05 ] [ 1.08e-05 2.6e-06 -2.46e-05 ] [ 1e-06 -5.9e-06 1.94e-05 ] [ 1.18e-05 5e-07 -6.1e-06 ] [ -7.2e-06 2.2e-06 -1.8e-06 ] [ -1.23e-05 -6.2e-06 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.568924145279999e-15 1.089480102144e-14 2.098851373248e-14 ] [ 1.730350750464e-14 4.16565921408e-15 -3.941354487168e-14 ] [ 1.6021766208e-15 -9.45284206272e-15 3.108222644352e-14 ] [ 1.890568412544e-14 8.010883104e-16 -9.77327738688e-15 ] [ -1.153567166976e-14 3.52478856576e-15 -2.88391791744e-15 ] [ -1.970677243584e-14 -9.93349504896e-15 0.0 ] ] } "relaxed-potential-energy" { "source-value" -20.568499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.295436822274818e-18 } }