{ "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" [ [ 0.3288529 1.174724 0.8712814 ] [ 1.395659 1.176494 2.521247 ] [ 2.395391 0.4245255 0.3168768 ] [ 2.017962 2.536207 0.5333854 ] [ 2.744316 1.992854 1.84914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.288529e-11 1.174724e-10 8.712814e-11 ] [ 1.395659e-10 1.176494e-10 2.521247e-10 ] [ 2.395391e-10 4.245255e-11 3.168768e-11 ] [ 2.017962e-10 2.536207e-10 5.333854e-11 ] [ 2.744316e-10 1.992854e-10 1.84914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.7573378 -4.0097342 -11.6880983 ] [ -19.00847 -16.033888 27.8384437 ] [ 5.4711034 -13.5016224 -7.440425 ] [ -16.811096 28.1094278 -39.8595895 ] [ 52.1058004 5.4358168 31.1496691 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.48590979540081e-08 -6.42430239086219e-09 -1.872639783787222e-08 ] [ -3.045492623117817e-08 -2.568912049412567e-08 4.460210365559705e-08 ] [ 8.765673957459389e-09 -2.163198375214959e-08 -1.192087498381584e-08 ] [ -2.69343449812244e-08 4.503626804522558e-08 -6.386210241158516e-08 ] [ 8.348269520895129e-08 8.70913859191187e-09 4.990727157767618e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.822001 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.336052320047422e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3402996 1.0571398 0.8980824 ] [ 1.0050969 1.1729261 3.2077603 ] [ 2.6205825 0.3908674 -0.0693187 ] [ 1.8989326 2.8920183 0.0130071 ] [ 3.0172693 1.7918529 2.0423994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.402996e-11 1.0571398e-10 8.980824e-11 ] [ 1.0050969e-10 1.1729261e-10 3.2077603e-10 ] [ 2.6205825e-10 3.908674e-11 -6.93187e-12 ] [ 1.8989326e-10 2.8920183e-10 1.30071e-12 ] [ 3.0172693e-10 1.7918529e-10 2.0423994e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 -9e-07 -1.8e-06 ] [ -4e-07 1.2e-06 -0.0 ] [ 4e-07 -2.4e-06 5e-07 ] [ -1.5e-06 2.3e-06 2e-06 ] [ 2e-06 -2e-07 -8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-16 -1.44195895872e-15 -2.88391791744e-15 ] [ -6.408706483200001e-16 1.92261194496e-15 0.0 ] [ 6.408706483200001e-16 -3.84522388992e-15 8.010883104e-16 ] [ -2.4032649312e-15 3.68500622784e-15 3.2043532416e-15 ] [ 3.2043532416e-15 -3.2043532416e-16 -1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.744302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.721426947121468e-18 } }