{ "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" [ [ 2.966654 1.561504 1.979713 ] [ 1.215751 3.296566 1.975446 ] [ 1.823708 4.192867 4.123573 ] [ 5.205541 2.34853 2.95907 ] [ 3.135824 2.260061 4.318186 ] [ 3.662306 3.63962 2.333021 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966654e-10 1.561504e-10 1.979713e-10 ] [ 1.215751e-10 3.296566e-10 1.975446e-10 ] [ 1.823708e-10 4.192867e-10 4.123573e-10 ] [ 5.205541e-10 2.34853e-10 2.95907e-10 ] [ 3.135824e-10 2.260061e-10 4.318186e-10 ] [ 3.662306e-10 3.63962e-10 2.333021e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.4572281 -11.8649438 -4.6031821 ] [ -2.3329474 0.4567852 -2.4707457 ] [ -0.2341514 2.1498606 0.895988 ] [ 13.4402829 -6.9646531 4.5079047 ] [ 0.039867 -4.1187101 7.0657281 ] [ -5.4558229 20.3416612 -5.3956931 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.743443276192804e-09 -1.900973556346592e-08 -7.375110741905047e-09 ] [ -3.737793781836146e-09 7.318505681674521e-10 -3.958570996482131e-09 ] [ -3.751518988075891e-10 3.44445639129906e-09 1.43553102611735e-09 ] [ 2.153370703931802e-08 -1.115860436880225e-08 7.222459519134438e-09 ] [ 6.38739753414336e-11 -6.598901030072831e-09 1.13205443707496e-08 ] [ -8.741191897605258e-09 3.259093400287448e-08 -8.644853337831876e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.8708499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.421266831640602e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7347695 1.109579 2.2637586 ] [ 1.5524151 3.2193252 1.7348585 ] [ 2.0062047 4.0637312 4.0886869 ] [ 4.8550978 2.4213921 2.7565116 ] [ 3.1885513 1.9539825 4.6175877 ] [ 3.6727457 4.531138 2.2276058 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7347695e-10 1.109579e-10 2.2637586e-10 ] [ 1.5524151e-10 3.2193252e-10 1.7348585e-10 ] [ 2.0062047e-10 4.063731200000001e-10 4.0886869e-10 ] [ 4.855097800000001e-10 2.4213921e-10 2.7565116e-10 ] [ 3.1885513e-10 1.9539825e-10 4.6175877e-10 ] [ 3.6727457e-10 4.531138000000001e-10 2.2276058e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 1.07e-05 3.1e-06 ] [ 1.55e-05 6.8e-06 1.01e-05 ] [ -6.8e-06 1.6e-06 -1.87e-05 ] [ -1.03e-05 -4.2e-06 2e-07 ] [ 1.46e-05 -1.1e-06 -4.2e-06 ] [ -1.26e-05 -1.38e-05 9.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 1.714328984256e-14 4.96674752448e-15 ] [ 2.48337376224e-14 1.089480102144e-14 1.618198387008e-14 ] [ -1.089480102144e-14 2.56348259328e-15 -2.996070280896e-14 ] [ -1.650241919424e-14 -6.72914180736e-15 3.2043532416e-16 ] [ 2.339177866368e-14 -1.76239428288e-15 -6.72914180736e-15 ] [ -2.018742542208e-14 -2.211003736704e-14 1.52206778976e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.599118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.659471878550046e-18 } }