{ "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" [ [ 1.697876 3.711698 1.143091 ] [ 3.423522 2.241155 2.183353 ] [ 3.951754 3.941629 0.5726112 ] [ 3.96365 5.193256 2.218192 ] [ 5.084028 3.36384 3.521791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.697876e-10 3.711698e-10 1.143091e-10 ] [ 3.423522e-10 2.241155e-10 2.183353e-10 ] [ 3.951754000000001e-10 3.941629e-10 5.726112e-11 ] [ 3.96365e-10 5.193256e-10 2.218192e-10 ] [ 5.084028e-10 3.36384e-10 3.521791e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.8199365 0.9257888 -0.6230147 ] [ -0.7160251 -8.3650768 1.4116628 ] [ 7.0881141 -40.3929965 -62.0213486 ] [ 2.8644273 45.0414626 58.5110182 ] [ 2.5834202 2.790822 2.7216822 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.893762607566374e-08 1.483277183378899e-09 -9.981795949785197e-10 ] [ -1.147198684577513e-09 -1.340233059057549e-08 2.261733153247015e-09 ] [ 1.135641079014594e-08 -6.471671516954378e-08 -9.936915553608861e-08 ] [ 4.589318489851707e-09 7.216437893890489e-08 9.374498619158873e-08 ] [ 4.139095480243606e-09 4.471389798053147e-09 4.360615626013714e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.8518969 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.171419209757034e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3704604 3.219714 1.1145299 ] [ 3.5418357 2.0963765 2.0169148 ] [ 3.6832073 4.1936164 0.4118081 ] [ 4.8302122 5.4738864 2.2803373 ] [ 4.6951144 3.4679847 3.8154481 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3704604e-10 3.219714e-10 1.1145299e-10 ] [ 3.5418357e-10 2.0963765e-10 2.0169148e-10 ] [ 3.6832073e-10 4.1936164e-10 4.118081e-11 ] [ 4.8302122e-10 5.473886399999999e-10 2.2803373e-10 ] [ 4.6951144e-10 3.4679847e-10 3.8154481e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.22e-05 1.59e-05 -4.46e-05 ] [ 3.21e-05 4.62e-05 -7e-06 ] [ -5.28e-05 1.5e-06 3.78e-05 ] [ -1.68e-05 -8.4e-05 -2.51e-05 ] [ 2.52e-05 2.03e-05 3.9e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.95465549348e-14 2.54746084806e-14 -7.145707787639999e-14 ] [ 5.14298699514e-14 7.40205604908e-14 -1.1215236438e-14 ] [ -8.45949262752e-14 2.403264951e-15 6.056227676519999e-14 ] [ -2.691656745119999e-14 -1.34582837256e-13 -4.02146335134e-14 ] [ 4.037485117679999e-14 3.252418567019999e-14 6.248488872599999e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.178089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.592015617857242e-18 } }