{ "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" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5557717 -0.3962906 -0.2882775 ] [ 1.6835298 -0.46317 1.6598865 ] [ -1.0581048 0.462219 0.47405 ] [ 2.487788 1.5857309 -0.5658193 ] [ -1.7728268 -2.962304 -0.7665477 ] [ -3.0736572 -1.1113129 1.2950842 ] [ 3.2890427 2.8851277 -1.8083762 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.492621065578457e-09 -6.349275395938403e-10 -4.61871474607935e-10 ] [ 2.697312108202693e-09 -7.4208015156978e-10 2.659431365392041e-09 ] [ -1.695270786883243e-09 7.40556481590846e-10 7.595118333476999e-10 ] [ 3.985875803945592e-09 2.54062099579179e-09 -9.065424615262362e-10 ] [ -2.840381675088991e-09 -4.746134251604736e-09 -1.228144813786442e-09 ] [ -4.924541746765864e-09 -1.780519561442778e-09 2.074953644302583e-09 ] [ 5.269627362168271e-09 4.622484187046161e-09 -2.897338093121711e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.556422 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.293501900704355e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1037379 0.5054364 1.1759022 ] [ 2.0443678 0.692089 2.0985007 ] [ 2.2602133 2.8211486 3.3212059 ] [ 1.7979812 0.6635655 4.5933767 ] [ 4.1058551 0.662788 3.5393076 ] [ 3.5236055 2.2361795 5.4466229 ] [ 4.765719 3.0863591 3.3443142 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.037379e-11 5.054364e-11 1.1759022e-10 ] [ 2.0443678e-10 6.92089e-11 2.0985007e-10 ] [ 2.2602133e-10 2.8211486e-10 3.3212059e-10 ] [ 1.7979812e-10 6.635655e-11 4.593376700000001e-10 ] [ 4.1058551e-10 6.627880000000001e-11 3.5393076e-10 ] [ 3.5236055e-10 2.2361795e-10 5.4466229e-10 ] [ 4.765719e-10 3.0863591e-10 3.3443142e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.6e-06 1e-07 1.6e-06 ] [ -5.7e-06 -4.9e-06 -6.2e-06 ] [ -1.27e-05 8.8e-06 -1e-06 ] [ 5e-07 -5e-07 7e-07 ] [ 5.4e-06 -1.17e-05 -2.2e-06 ] [ -5.1e-06 -2e-07 1.44e-05 ] [ 1.49e-05 8.4e-06 -7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.165659248399999e-15 1.602176634e-16 2.5634826144e-15 ] [ -9.1324068138e-15 -7.850665506599998e-15 -9.9334951308e-15 ] [ -2.03476432518e-14 1.40991543792e-14 -1.602176634e-15 ] [ 8.010883169999999e-16 -8.010883169999999e-16 1.1215236438e-15 ] [ 8.6517538236e-15 -1.87454666178e-14 -3.5247885948e-15 ] [ -8.1711008334e-15 -3.204353268e-16 2.30713435296e-14 ] [ 2.38724318466e-14 1.34582837256e-14 -1.18561070916e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.349854 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.741059048611144e-18 } }