{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1226517 0.1643142 2.08525 ] [ 0.897513 2.739377 0.422181 ] [ 0.4967103 2.508008 2.34433 ] [ 2.384655 1.344784 0.6822557 ] [ 2.452846 2.947826 1.504929 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.226517e-11 1.643142e-11 2.08525e-10 ] [ 8.97513e-11 2.739377e-10 4.22181e-11 ] [ 4.967103e-11 2.508008e-10 2.34433e-10 ] [ 2.384655e-10 1.344784e-10 6.822557000000001e-11 ] [ 2.452846e-10 2.947826e-10 1.504929e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2018306 0.3955881 0.5598296 ] [ -17.0586655 5.3361202 -21.0017025 ] [ -10.395484 -0.620359 15.4452241 ] [ 9.3005748 -26.224917 -12.1514593 ] [ 18.3554054 21.1135677 17.1481081 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.233682713462004e-10 6.338020105084554e-10 8.969459041415663e-10 ] [ -2.733099527132192e-08 8.549407100655407e-09 -3.364843701971939e-08 ] [ -1.665540156392085e-08 -9.939246944916058e-10 2.474597715991368e-08 ] [ 1.490116362732922e-08 -4.201694924598937e-08 -1.9468784159462e-08 ] [ 2.940860163947742e-08 3.382766482931712e-08 2.747429811512614e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.6168105 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.794769272705857e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.692997 0.5007368 3.2617341 ] [ 0.6305746 2.2412069 -0.3004129 ] [ 0.539763 2.0251685 2.0682226 ] [ 2.9839258 2.5765962 -0.1796178 ] [ 2.8931096 2.3606008 2.1890197 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.92997e-11 5.007368e-11 3.2617341e-10 ] [ 6.305746000000001e-11 2.2412069e-10 -3.004129e-11 ] [ 5.39763e-11 2.0251685e-10 2.0682226e-10 ] [ 2.9839258e-10 2.5765962e-10 -1.796178e-11 ] [ 2.8931096e-10 2.3606008e-10 2.1890197e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 1.17e-05 5.8e-06 ] [ -6.8e-06 -8.9e-06 -2.7e-06 ] [ -1.9e-05 -1.3e-05 -3.9e-06 ] [ 1.01e-05 1.9e-05 1.6e-06 ] [ 1.62e-05 -8.8e-06 -8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.613059803999998e-16 1.87454666178e-14 9.2926244772e-15 ] [ -1.08948011112e-14 -1.42593720426e-14 -4.3258769118e-15 ] [ -3.0441356046e-14 -2.082829624199999e-14 -6.248488872599999e-15 ] [ 1.61819840034e-14 3.0441356046e-14 2.5634826144e-15 ] [ 2.59552614708e-14 -1.40991543792e-14 -1.2817413072e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.301703 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.81073244710077e-18 } }