{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.693951 4.828533 2.524683 ] [ 0.9874005 3.253704 2.692751 ] [ 1.797506 3.29632 4.784436 ] [ 3.246699 2.730573 2.280252 ] [ 4.077425 2.843272 4.278983 ] [ 4.93943 4.110777 2.41493 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.693951e-10 4.828533000000001e-10 2.524683e-10 ] [ 9.874005e-11 3.253704e-10 2.692751e-10 ] [ 1.797506e-10 3.29632e-10 4.784436000000001e-10 ] [ 3.246699e-10 2.730573e-10 2.280252e-10 ] [ 4.077425e-10 2.843272e-10 4.278983e-10 ] [ 4.93943e-10 4.110777e-10 2.41493e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7821899 2.4691916 -0.2128698 ] [ -0.2571297 -0.0220799 -0.2614018 ] [ 0.5624642 0.0544055 0.5086427 ] [ -1.0559658 -3.2432192 -2.358012 ] [ 0.4374462 -0.2808977 2.0548705 ] [ 1.095375 1.0225997 0.2687703 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.253206381130796e-09 3.956081086389073e-09 -3.410550196442531e-10 ] [ -4.119671972474298e-10 -3.53758998610566e-11 -4.188118560455412e-10 ] [ 9.011669987015026e-10 8.7167220861087e-11 8.149354489946716e-10 ] [ -1.691843731063117e-09 -5.196210021180172e-09 -3.777951729091607e-09 ] [ 7.008660802720907e-10 -4.500477314843417e-10 3.292265500995897e-09 ] [ 1.75498423046775e-09 1.63838534527541e-09 4.306174945731702e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.360047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.78138616685418e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4943753 5.2278054 2.8963789 ] [ 1.3206377 3.1984427 2.4853773 ] [ 2.0364666 3.7333836 4.6913536 ] [ 3.3337899 2.1130855 2.0953093 ] [ 4.0496134 2.6480155 4.3012896 ] [ 4.5075287 4.1424463 2.5063263 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4943753e-10 5.227805400000001e-10 2.896378900000001e-10 ] [ 1.3206377e-10 3.198442700000001e-10 2.4853773e-10 ] [ 2.0364666e-10 3.7333836e-10 4.6913536e-10 ] [ 3.3337899e-10 2.1130855e-10 2.0953093e-10 ] [ 4.0496134e-10 2.6480155e-10 4.3012896e-10 ] [ 4.5075287e-10 4.1424463e-10 2.5063263e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.5e-06 5.6e-06 1.52e-05 ] [ -1.6e-06 2.2e-06 -4.1e-06 ] [ -3.4e-06 -1.6e-06 -1.19e-05 ] [ 3e-07 -5.6e-06 6.7e-06 ] [ 6.8e-06 5.4e-06 6e-07 ] [ 4e-07 -6.1e-06 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.005441585e-15 8.972189150399999e-15 2.43530848368e-14 ] [ -2.5634826144e-15 3.5247885948e-15 -6.568924199399999e-15 ] [ -5.4474005556e-15 -2.5634826144e-15 -1.90659019446e-14 ] [ 4.806529901999999e-16 -8.972189150399999e-15 1.07345834478e-14 ] [ 1.08948011112e-14 8.6517538236e-15 9.613059803999998e-16 ] [ 6.408706536e-16 -9.773277467399999e-15 -1.05743657844e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031399002736e-18 } }