{ "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" [ [ 2.649462 0.9916265 2.612716 ] [ 1.648491 2.667782 3.780456 ] [ 2.525478 3.798893 2.25676 ] [ 4.349928 2.588165 2.084291 ] [ 3.878534 1.770814 4.034173 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.649462e-10 9.916265e-11 2.612716e-10 ] [ 1.648491e-10 2.667782e-10 3.780456e-10 ] [ 2.525478e-10 3.798893e-10 2.25676e-10 ] [ 4.349928e-10 2.588165e-10 2.084291e-10 ] [ 3.878534e-10 1.770814e-10 4.034173e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7552504 -2.2957245 -2.3493289 ] [ -1.9126632 -0.8916545 2.5130427 ] [ -0.1510098 2.9142308 -2.2464828 ] [ 1.9873621 0.2190589 -2.0139097 ] [ 1.8315612 0.0540893 4.0966787 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.812221154529848e-09 -3.67815612169777e-09 -3.764039838149782e-09 ] [ -3.064424262504515e-09 -1.428587993731114e-09 4.026338261012109e-09 ] [ -2.419443710716838e-10 4.669112455375281e-09 -3.599262221189322e-09 ] [ 3.184105093683991e-09 3.509710481581651e-10 -3.226639037742342e-09 ] [ 2.934484534204393e-09 8.666061189543745e-11 6.563602836069337e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.30289 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.131357934707411e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5225813 1.1887941 2.3024755 ] [ 1.7641107 2.6955372 4.0720693 ] [ 2.3643034 3.6069058 1.9786334 ] [ 4.5005342 2.6186797 2.1608706 ] [ 3.9003635 1.7073637 4.2543472 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5225813e-10 1.1887941e-10 2.3024755e-10 ] [ 1.7641107e-10 2.6955372e-10 4.0720693e-10 ] [ 2.3643034e-10 3.6069058e-10 1.9786334e-10 ] [ 4.5005342e-10 2.6186797e-10 2.1608706e-10 ] [ 3.9003635e-10 1.7073637e-10 4.2543472e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.65e-05 1.65e-05 -1.45e-05 ] [ -1.79e-05 1.96e-05 -6.7e-06 ] [ -1.67e-05 -3.55e-05 1.04e-05 ] [ 2.77e-05 -5e-07 2.79e-05 ] [ 3.33e-05 -1e-07 -1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.24576804512e-14 2.64359142432e-14 -2.32315610016e-14 ] [ -2.867896151232001e-14 3.140266176767999e-14 -1.073458335936e-14 ] [ -2.675634956736e-14 -5.68772700384e-14 1.666263685632e-14 ] [ 4.438029239616e-14 -8.010883104e-16 4.470072772032e-14 ] [ 5.335248147264001e-14 -1.6021766208e-16 -2.739722021568e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }