{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.054063 0.143936 1.020128 ] [ 0.3465957 1.342343 2.730037 ] [ 0.4577023 2.369538 0.7306134 ] [ 2.27069 2.392327 1.674561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.054063e-10 1.43936e-11 1.020128e-10 ] [ 3.465957e-11 1.342343e-10 2.730037e-10 ] [ 4.577023e-11 2.369538e-10 7.306134e-11 ] [ 2.27069e-10 2.392327e-10 1.674561e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5930631 -7.5104979 -3.9997609 ] [ -2.7258142 -0.0430525 7.8240352 ] [ -8.184274 4.1396732 -8.079668 ] [ 10.3170251 3.4138772 4.2553937 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.501918413076052e-10 -1.203314424508607e-08 -6.40832345556681e-09 ] [ -4.367235819865402e-09 -6.8977709535285e-11 1.253548638103352e-08 ] [ -1.311265256905371e-08 6.632487673436008e-09 -1.294505528007751e-08 ] [ 1.652969654761151e-08 5.469634281185345e-09 6.817892354610805e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.5623072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.707445358969964e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2374269 0.1824884 0.9931621 ] [ 1.0925762 0.9134438 3.0907256 ] [ 0.9719493 2.2106282 -0.0130559 ] [ 1.8270986 2.9415836 2.0845076 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.374269e-11 1.824884e-11 9.931621000000001e-11 ] [ 1.0925762e-10 9.134438e-11 3.0907256e-10 ] [ 9.719493e-11 2.2106282e-10 -1.30559e-12 ] [ 1.8270986e-10 2.9415836e-10 2.0845076e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 -0.0 ] [ -0.0 -0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -8.6361973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383671352067389e-18 } }