{ "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" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9872399 -2.2489247 0.7621947 ] [ -1.2798777 0.8786828 -5.2188379 ] [ -8.470202 -0.1621661 3.3140346 ] [ 1.5018192 6.412524 1.2110075 ] [ 0.5695295 -7.6555908 -7.1011847 ] [ 1.9154853 3.6554209 -4.3166863 ] [ 6.7504857 -0.8799462 11.349472 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.58173268690093e-09 -3.603174576279654e-09 1.22117052883767e-09 ] [ -2.050590128423276e-09 1.407805039259082e-09 -8.361500071124968e-09 ] [ -1.35707596178534e-08 -2.598187341063149e-10 5.30966875664228e-09 ] [ 2.406179610908559e-09 1.02739960331189e-08 1.940247904113456e-09 ] [ 9.124868497559136e-10 -1.226560859817157e-08 -1.137735210632266e-08 ] [ 3.068945765146074e-09 5.856629905163695e-09 -6.916093869187654e-09 ] [ 1.081547036758472e-08 -1.409829229201801e-09 1.818385869682422e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -18.606318 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.981060769877022e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9204797 1.6256993 2.9941233 ] [ 2.0085944 3.6863078 1.3501921 ] [ 1.2618071 3.8989617 3.8707937 ] [ 2.8885549 5.5927767 2.9462558 ] [ 3.9543033 1.9145673 1.5277624 ] [ 4.5526043 4.3663514 1.4981792 ] [ 3.8224993 3.2730328 3.7846555 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9204797e-10 1.6256993e-10 2.9941233e-10 ] [ 2.0085944e-10 3.6863078e-10 1.3501921e-10 ] [ 1.2618071e-10 3.8989617e-10 3.8707937e-10 ] [ 2.8885549e-10 5.5927767e-10 2.9462558e-10 ] [ 3.9543033e-10 1.9145673e-10 1.5277624e-10 ] [ 4.5526043e-10 4.3663514e-10 1.4981792e-10 ] [ 3.8224993e-10 3.2730328e-10 3.7846555e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.06e-05 -1.22e-05 -2e-06 ] [ -3.29e-05 -8.1e-06 -4.58e-05 ] [ -4.66e-05 -1.86e-05 2.93e-05 ] [ 1.24e-05 1.87e-05 -6.7e-06 ] [ 1.7e-06 -3.26e-05 -1.68e-05 ] [ 3.83e-05 3.92e-05 -1.27e-05 ] [ 6.77e-05 1.37e-05 5.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.504837080448e-14 -1.954655477376e-14 -3.2043532416e-15 ] [ -5.271161082432e-14 -1.297763062848e-14 -7.337968923264e-14 ] [ -7.466143052928e-14 -2.980048514688e-14 4.694377498944e-14 ] [ 1.986699009792e-14 2.996070280896e-14 -1.073458335936e-14 ] [ 2.72370025536e-15 -5.223095783807999e-14 -2.691656722944e-14 ] [ 6.136336457664001e-14 6.280532353535999e-14 -2.034764308416e-14 ] [ 1.0846735722816e-13 2.194981970496e-14 8.747884349568e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.454184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.917992188554143e-18 } }