{ "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" [ [ 0.5286717 0.5459164 0.2171681 ] [ 0.0530602 2.45185 0.0097729 ] [ 0.1982568 1.952172 2.366336 ] [ 2.940741 0.007829 0.5912968 ] [ 2.574768 0.9414562 2.330693 ] [ 2.158325 2.742494 1.504322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.286717e-11 5.459164e-11 2.171681e-11 ] [ 5.30602e-12 2.45185e-10 9.7729e-13 ] [ 1.982568e-11 1.952172e-10 2.366336e-10 ] [ 2.940741e-10 7.828999999999999e-13 5.912968e-11 ] [ 2.574768e-10 9.414562e-11 2.330693e-10 ] [ 2.158325e-10 2.742494e-10 1.504322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.5721267 -27.336916 -0.2931825 ] [ -5.1266788 24.3680584 -4.8615657 ] [ -5.285809 -1.9118172 4.8703794 ] [ 2.2911946 -9.1134995 -15.3414617 ] [ 3.2521962 -10.0064702 23.8696994 ] [ 1.2969703 24.0006445 -8.243869 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.723177932427527e-09 -4.379856806082074e-08 -4.69730150997705e-10 ] [ -8.213844983383158e-09 3.904193378442742e-08 -7.789086969195853e-09 ] [ -8.468799671586907e-09 -3.063068846319305e-09 7.803208073394939e-09 ] [ 3.670898452066976e-09 -1.460143595287068e-08 -2.457973146714592e-08 ] [ 5.210592760823591e-09 -1.603213274325731e-08 3.824347463928381e-08 ] [ 2.07797550965197e-09 3.845327181884061e-08 -1.320813428555694e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.7524297 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.807701918067629e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.297029 0.1060077 0.3497713 ] [ 0.403344 2.5743499 -0.1219318 ] [ 0.179907 1.7052054 2.3443258 ] [ 2.7594517 0.134758 0.2947056 ] [ 2.5997786 0.9424022 2.6100481 ] [ 2.2143123 3.1789944 1.5426698 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.97029e-11 1.060077e-11 3.497713e-11 ] [ 4.03344e-11 2.5743499e-10 -1.219318e-11 ] [ 1.79907e-11 1.7052054e-10 2.3443258e-10 ] [ 2.7594517e-10 1.34758e-11 2.947056e-11 ] [ 2.5997786e-10 9.424022e-11 2.610048100000001e-10 ] [ 2.2143123e-10 3.1789944e-10 1.5426698e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.9e-06 -4.53e-05 -4.61e-05 ] [ -8.7e-06 4.9e-05 1.76e-05 ] [ -2.82e-05 -2.7e-06 2.83e-05 ] [ 7e-06 8e-07 8.6e-06 ] [ 1.9e-05 2.52e-05 2.99e-05 ] [ 2.09e-05 -2.71e-05 -3.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.58615486766e-14 -7.25786015202e-14 -7.386034282739999e-14 ] [ -1.39389367158e-14 7.850665506599998e-14 2.81983087584e-14 ] [ -4.51813810788e-14 -4.3258769118e-15 4.53415987422e-14 ] [ 1.1215236438e-14 1.2817413072e-15 1.37787190524e-14 ] [ 3.0441356046e-14 4.037485117679999e-14 4.790508135659999e-14 ] [ 3.34854916506e-14 -4.34189867814e-14 -6.13633650822e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.642267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.506167469018928e-18 } }