{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0323974 3.0476457 -3.6781133 ] [ -1.4986448 2.2670868 -0.3281635 ] [ 10.5523023 -1.5820286 9.4113943 ] [ -1.2485341 3.5698668 -1.4290196 ] [ 0.3045091 1.7622837 0.518095 ] [ -11.8554654 -10.1018779 3.379448 ] [ 3.7134355 1.0370235 -7.8736409 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.190635728235159e-11 4.882866729250573e-09 -5.892987186464631e-09 ] [ -2.401093681225603e-09 3.632273498209831e-09 -5.257758918316589e-10 ] [ 1.690665217996446e-08 -2.534689257239732e-09 1.507871604082078e-08 ] [ -2.000372161772219e-09 5.719557173452351e-09 -2.289541812648026e-09 ] [ 4.878773648603694e-10 2.823489766619065e-09 8.300797031922299e-10 ] [ -1.899454964907546e-08 -1.618499273090099e-08 5.414472621418032e-09 ] [ 5.949579589966107e-09 1.661494820608899e-09 -1.261496347448673e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.7489307236328315 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.608625841889233e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0323974 3.0476457 -3.6781133 ] [ -1.4986448 2.2670868 -0.3281635 ] [ 10.5523023 -1.5820286 9.4113943 ] [ -1.2485341 3.5698668 -1.4290196 ] [ 0.3045091 1.7622837 0.518095 ] [ -11.8554654 -10.1018779 3.379448 ] [ 3.7134355 1.0370235 -7.8736409 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.190635728235159e-11 4.882866729250573e-09 -5.892987186464631e-09 ] [ -2.401093681225603e-09 3.632273498209831e-09 -5.257758918316589e-10 ] [ 1.690665217996446e-08 -2.534689257239732e-09 1.507871604082078e-08 ] [ -2.000372161772219e-09 5.719557173452351e-09 -2.289541812648026e-09 ] [ 4.878773648603694e-10 2.823489766619065e-09 8.300797031922299e-10 ] [ -1.899454964907546e-08 -1.618499273090099e-08 5.414472621418032e-09 ] [ 5.949579589966107e-09 1.661494820608899e-09 -1.261496347448673e-08 ] ] } "relaxed-potential-energy" { "source-value" 4.7489307236328315 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.608625841889233e-19 } }