{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.302316 2.639916 2.839286 ] [ 2.238062 3.048613 5.055223 ] [ 2.960065 4.797857 2.877262 ] [ 0.8426098 4.264099 3.709155 ] [ 4.78415 2.692863 2.00084 ] [ 4.277135 2.539995 4.347514 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.302316e-10 2.639916e-10 2.839286e-10 ] [ 2.238062e-10 3.048613e-10 5.055223e-10 ] [ 2.960065e-10 4.797856999999999e-10 2.877262e-10 ] [ 8.426098e-11 4.264099e-10 3.709155e-10 ] [ 4.78415e-10 2.692863e-10 2.00084e-10 ] [ 4.277135e-10 2.539995e-10 4.347514000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2030472 -3.7934196 -2.8181888 ] [ -1.0845402 1.2133997 2.6471651 ] [ 3.4665451 -2.2346867 1.4925138 ] [ -1.7909753 1.5138718 -0.458936 ] [ -2.9741726 2.154128 1.3133017 ] [ 1.1800958 1.1467069 -2.1758559 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.927494097558902e-09 -6.077728196004488e-09 -4.515236208360407e-09 ] [ -1.737624952757756e-09 1.944080631025734e-09 4.241226034617694e-09 ] [ 5.554017514168798e-09 -3.580362785552704e-09 2.391270716581367e-09 ] [ -2.869458754090266e-09 2.425490004848414e-09 -7.352965296434689e-10 ] [ -4.765149805943951e-09 3.451293519810663e-09 2.104141279796895e-09 ] [ 1.890721901064273e-09 1.837226986090044e-09 -3.486105453209743e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.411123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.270222407487316e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3095459 2.3183233 2.8961016 ] [ 2.2094177 3.2965405 5.1391652 ] [ 3.2772687 4.5743445 3.3432831 ] [ 0.8877823 4.2214058 3.3333425 ] [ 4.3828849 3.0123337 1.8694951 ] [ 4.3374383 2.5603952 4.2478926 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3095459e-10 2.3183233e-10 2.8961016e-10 ] [ 2.2094177e-10 3.2965405e-10 5.1391652e-10 ] [ 3.2772687e-10 4.5743445e-10 3.3432831e-10 ] [ 8.877823e-11 4.221405800000001e-10 3.3333425e-10 ] [ 4.3828849e-10 3.0123337e-10 1.8694951e-10 ] [ 4.3374383e-10 2.5603952e-10 4.247892600000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-07 -4.9e-06 0.0 ] [ -8.1e-06 1.49e-05 8.7e-06 ] [ -1.6e-06 3e-06 -5.6e-06 ] [ 2.13e-05 -1.3e-05 -5.3e-06 ] [ -1.27e-05 1.66e-05 7.3e-06 ] [ 1.8e-06 -1.66e-05 -5.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-15 -7.850665441919999e-15 0.0 ] [ -1.297763062848e-14 2.387243164992e-14 1.393893660096e-14 ] [ -2.56348259328e-15 4.8065298624e-15 -8.972189076479999e-15 ] [ 3.412636202304e-14 -2.08282960704e-14 -8.491536090240001e-15 ] [ -2.034764308416e-14 2.659613190528e-14 1.169588933184e-14 ] [ 2.88391791744e-15 -2.659613190528e-14 -8.17110076608e-15 ] ] } "relaxed-potential-energy" { "source-value" -23.902638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.829624777904567e-18 } }