{ "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" [ [ 1.30949 2.712734 2.978333 ] [ 0.0672006 1.690783 1.932827 ] [ 2.539316 0.8650755 1.245634 ] [ 2.964133 0.3086468 2.850804 ] [ 2.353048 2.858216 0.4219119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.30949e-10 2.712734e-10 2.978333e-10 ] [ 6.72006e-12 1.690783e-10 1.932827e-10 ] [ 2.539316e-10 8.650755e-11 1.245634e-10 ] [ 2.964133e-10 3.086468e-11 2.850804e-10 ] [ 2.353048e-10 2.858216e-10 4.219119e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 319.4592435 308.0977678 135.1091626 ] [ -208.4855771 -290.8934841 -259.611693 ] [ -259.4694321 128.8983749 -709.1801703 ] [ 190.9155219 -229.2738087 705.8100842 ] [ -42.4197562 83.1711502 127.8726166 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.118301312341544e-07 4.93627040489827e-07 2.164687415735857e-07 ] [ -3.340307174036159e-07 -4.660627393680766e-07 -4.15943785010907e-07 ] [ -4.15715857922873e-07 2.065179627238935e-07 -1.136231888789622e-06 ] [ 3.058803857360104e-07 -3.673371360609117e-07 1.130832415630119e-06 ] [ -6.796394164367584e-08 1.332548723754853e-07 2.04874516757042e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 378.64498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.066561345392836e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.5660939 2.9718792 3.4260957 ] [ -0.1762719 1.4593527 1.5841868 ] [ 2.3037527 0.2477125 0.5365268 ] [ 3.1354058 0.5589694 3.2784493 ] [ 2.4042071 3.1975414 0.6042513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5660939e-10 2.9718792e-10 3.4260957e-10 ] [ -1.762719e-11 1.4593527e-10 1.5841868e-10 ] [ 2.3037527e-10 2.477125e-11 5.365268e-11 ] [ 3.1354058e-10 5.589694e-11 3.2784493e-10 ] [ 2.4042071e-10 3.1975414e-10 6.042513000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.72e-05 -3.8e-06 -4.2e-06 ] [ 7.77e-05 3.4e-05 4.6e-06 ] [ -5.5e-06 -2.6e-06 -1.51e-05 ] [ -8.2e-06 -1.21e-05 1.78e-05 ] [ -4.68e-05 -1.56e-05 -3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.755743787776e-14 -6.08827115904e-15 -6.72914180736e-15 ] [ 1.2448912343616e-13 5.44740051072e-14 7.370012455680001e-15 ] [ -8.8119714144e-15 -4.16565921408e-15 -2.419286697408e-14 ] [ -1.313784829056e-14 -1.938633711168e-14 2.851874385024e-14 ] [ -7.498186585344001e-14 -2.499395528448e-14 -4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }