{ "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" [ [ 2.596447 0.5894877 3.838334 ] [ 1.369077 2.86119 3.866131 ] [ 2.011058 5.105046 2.796353 ] [ 3.116098 2.834339 2.386368 ] [ 3.638135 2.33604 4.892399 ] [ 3.921466 4.7829 1.89112 ] [ 5.122204 3.316972 3.335617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.596447e-10 5.894877e-11 3.838334e-10 ] [ 1.369077e-10 2.86119e-10 3.866131e-10 ] [ 2.011058e-10 5.105046e-10 2.796353e-10 ] [ 3.116098e-10 2.834339e-10 2.386368e-10 ] [ 3.638135e-10 2.33604e-10 4.892399e-10 ] [ 3.921466e-10 4.7829e-10 1.89112e-10 ] [ 5.122204e-10 3.316972e-10 3.335617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.268383 8.9311197 5.5295328 ] [ 6.8777435 -0.4472264 -6.144105 ] [ -2.1288737 1.0115259 0.8591982 ] [ -8.3593988 -2.9527404 6.8604735 ] [ -1.137203 -6.3695253 -9.7375944 ] [ 2.0001519 3.8131781 -3.0082719 ] [ -2.5208029 -3.9863317 5.6407667 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.440880072020167e-09 1.430923118090631e-08 8.859288176106763e-09 ] [ 1.101935983955916e-08 -7.165356822845493e-10 -9.843941386740384e-09 ] [ -3.410831670775993e-09 1.620643148313679e-09 1.376587268673443e-09 ] [ -1.339323332130357e-08 -4.730811636171641e-09 1.099169024931795e-08 ] [ -1.822000059703622e-09 -1.020510452125411e-08 -1.5601346090513e-08 ] [ 3.2045966122287e-09 6.109384802766564e-09 -4.819782907189596e-09 ] [ -4.038771472024841e-09 -6.386807452493919e-09 9.037504530127167e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6693327 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.549197879067694e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4365556 0.8440365 4.8554165 ] [ 1.424955 1.344106 2.9640051 ] [ 2.6280363 6.9924452 2.6176177 ] [ 2.2087125 2.8912845 1.6002056 ] [ 4.4864624 1.6227712 5.0660141 ] [ 2.9440889 4.9455531 1.8700917 ] [ 5.6456742 3.1857782 4.0329712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4365556e-10 8.440365e-11 4.8554165e-10 ] [ 1.424955e-10 1.344106e-10 2.9640051e-10 ] [ 2.628036300000001e-10 6.9924452e-10 2.6176177e-10 ] [ 2.2087125e-10 2.8912845e-10 1.6002056e-10 ] [ 4.4864624e-10 1.6227712e-10 5.066014100000001e-10 ] [ 2.9440889e-10 4.9455531e-10 1.8700917e-10 ] [ 5.6456742e-10 3.1857782e-10 4.0329712e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1097619 -0.1536188 0.0298894 ] [ 0.0965975 0.3152322 -0.4632765 ] [ 0.0999903 -0.1840542 -0.0998778 ] [ -0.4734548 -0.5208046 0.3126631 ] [ 0.1848984 0.3059763 -0.0213019 ] [ -0.0202539 0.5155095 -0.0448598 ] [ 0.0024606 -0.2782404 0.2867635 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.758579500345875e-10 -2.461244498753511e-10 4.788809788973952e-11 ] [ 1.54766256127728e-10 5.050576609633498e-10 -7.422507772660512e-10 ] [ 1.602021209667783e-10 -2.948873362000474e-10 -1.600218760969382e-10 ] [ -7.585582115655399e-10 -8.344209541250956e-10 5.009415090068526e-10 ] [ 2.962398937033267e-10 4.90228074378887e-10 -3.412940615861952e-11 ] [ -3.245032506002112e-11 8.259372687002975e-10 -7.187332277376383e-11 ] [ 3.94231579314048e-12 -4.457902638420404e-10 4.594457753987808e-10 ] ] } "relaxed-potential-energy" { "source-value" -15.870826 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.542786636998478e-18 } }