{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -2.8555523e-10 1.927188e-10 -2.5484497e-10 ] [ 2.1200967e-10 -3.1106173e-10 4.5469042e-10 ] [ 4.0872626e-10 6.564044400000001e-10 2.9557953e-10 ] ] "source-value" [ [ -2.8555523 1.927188 -2.5484497 ] [ 2.1200967 -3.1106173 4.5469042 ] [ 4.0872626 6.5640444 2.9557953 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.408706483200001e-16 -4.8065298624e-16 -4.8065298624e-16 ] [ 0.0 0.0 0.0 ] [ 6.408706483200001e-16 4.8065298624e-16 4.8065298624e-16 ] ] "source-value" [ [ -4e-07 -3e-07 -3e-07 ] [ 0.0 0.0 0.0 ] [ 4e-07 3e-07 3e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.293247427753774e-31 "source-value" 2.6796343e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.826723676925896e-08 -1.095982215524193e-09 -1.866661982706187e-08 ] [ 3.76503030373676e-09 -1.668079288200457e-08 1.02183913719704e-08 ] [ 1.45022064655222e-08 1.77767749373111e-08 8.448228294873804e-09 ] ] "source-value" [ [ -11.4015125 -0.6840583 -11.6507878 ] [ 2.3499471 -10.4113321 6.3778183 ] [ 9.0515654 11.0953903 5.2729694 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.448098899509007e-18 "source-value" 34.004359 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.10209e-11 2.139572e-10 6.780668e-11 ] [ 1.535127e-10 6.598691e-11 2.515065e-10 ] [ 1.506471e-10 2.581174e-10 1.761118e-10 ] ] "source-value" [ [ 0.310209 2.139572 0.6780668 ] [ 1.535127 0.6598691 2.515065 ] [ 1.506471 2.581174 1.761118 ] ] } "instance-id" 1 }