{ "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" [ [ -1.893762591964058e-08 1.483277171158487e-09 -9.981795867547258e-10 ] [ -1.147198675125982e-09 -1.340233048015648e-08 2.261733134613066e-09 ] [ 1.135641069658283e-08 -6.471671463635623e-08 -9.936915471740682e-08 ] [ 4.589318452041268e-09 7.216437834435758e-08 9.374498541924331e-08 ] [ 4.13909544614246e-09 4.471389761214297e-09 4.360615590087509e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.8518969 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.171419158911996e-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" [ [ 1.954655477376e-14 2.547460827072e-14 -7.145707728768e-14 ] [ 5.142986952768e-14 7.402055988096e-14 -1.12152363456e-14 ] [ -8.459492557824e-14 2.4032649312e-15 6.056227626623999e-14 ] [ -2.691656722944e-14 -1.345828361472e-13 -4.021463318208e-14 ] [ 4.037485084416e-14 3.252418540224e-14 6.248488821120001e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.178089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.592015596502165e-18 } }