{ "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" [ [ 2.114 2.095272 1.915779 ] [ 2.14246 0.9228837 3.956719 ] [ 3.791491 3.03012 0.940196 ] [ 4.524648 0.3016751 5.057567 ] [ 3.666195 2.4276 3.537085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.114e-10 2.095272e-10 1.915779e-10 ] [ 2.14246e-10 9.228837e-11 3.956719e-10 ] [ 3.791491000000001e-10 3.03012e-10 9.40196e-11 ] [ 4.524648e-10 3.016751e-11 5.057567e-10 ] [ 3.666195e-10 2.4276e-10 3.537085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.0752554 -0.504311 -3.8973719 ] [ -2.2675737 -3.7688209 2.9620494 ] [ 2.345078 1.3983525 -2.664883 ] [ -0.0471328 -0.1034646 -0.101094 ] [ 5.0448839 2.978244 3.7012995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.131455546468952e-09 -8.079952938122688e-10 -6.244278140742876e-09 ] [ -3.633053568080953e-09 -6.038316733962416e-09 4.745726298334668e-09 ] [ 3.757229145552422e-09 2.240407683137232e-09 -4.269613239767367e-09 ] [ -7.551507023284224e-11 -1.657685632004237e-10 -1.619704433031552e-10 ] [ 8.082795039230325e-09 4.771672907837876e-09 5.93013552547873e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.2730978 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.244080772751914e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7404189 1.7003756 1.7920929 ] [ 1.9284731 0.4260506 3.7369319 ] [ 3.6354585 3.0508978 1.6291249 ] [ 3.9397368 0.9889907 4.7759475 ] [ 4.9947067 2.6112361 3.4732488 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7404189e-10 1.7003756e-10 1.7920929e-10 ] [ 1.9284731e-10 4.260506e-11 3.7369319e-10 ] [ 3.6354585e-10 3.0508978e-10 1.6291249e-10 ] [ 3.9397368e-10 9.889907000000001e-11 4.775947500000001e-10 ] [ 4.9947067e-10 2.6112361e-10 3.4732488e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.45e-05 -1.7e-05 1.05e-05 ] [ -2.59e-05 -3e-07 -2.31e-05 ] [ 3.7e-06 -4.1e-06 9.1e-06 ] [ 2.2e-05 2.46e-05 -1.42e-05 ] [ 1.48e-05 -3.2e-06 1.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.32315610016e-14 -2.72370025536e-14 1.68228545184e-14 ] [ -4.149637447872e-14 -4.8065298624e-16 -3.701027994048e-14 ] [ 5.928053496960001e-15 -6.568924145279999e-15 1.457980724928e-14 ] [ 3.52478856576e-14 3.941354487168e-14 -2.275090801536e-14 ] [ 2.371221398784e-14 -5.126965186560001e-15 2.851874385024e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.4797183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198382979042992e-18 } }