{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.944727 -8.4190587 -4.561465 ] [ -13.7136906 2.0394316 11.5786054 ] [ 3.0999195 4.7584182 -18.2468097 ] [ 12.3106736 -9.9258207 7.3735188 ] [ 4.2478246 11.5470296 3.8561505 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.524502616438523e-09 -1.348881901828284e-08 -7.308272579597473e-09 ] [ -2.197175446420472e-08 3.267529629240737e-09 1.855097087334863e-08 ] [ 4.966618549262026e-09 7.623826392029218e-09 -2.923461190552666e-08 ] [ 1.972387342821977e-08 -1.590291786779269e-08 1.181367943438927e-08 ] [ 6.805765263379112e-09 1.850038086480558e-08 6.178234177386231e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.2766095 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.005623699879118e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7322708 0.755677 0.951122 ] [ 1.9065881 2.5284769 2.5223394 ] [ 3.5955176 2.7577505 -0.2897666 ] [ 4.8514427 1.0906912 2.2511955 ] [ 4.1700827 3.4956098 2.0380503 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7322708e-10 7.556770000000001e-11 9.511220000000001e-11 ] [ 1.9065881e-10 2.5284769e-10 2.5223394e-10 ] [ 3.5955176e-10 2.7577505e-10 -2.897666e-11 ] [ 4.8514427e-10 1.0906912e-10 2.2511955e-10 ] [ 4.1700827e-10 3.4956098e-10 2.0380503e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 -1.92e-05 -5e-06 ] [ -5.5e-06 5e-06 -1.21e-05 ] [ -1.22e-05 1.1e-06 7.8e-06 ] [ 3.3e-06 -1.2e-06 -3e-07 ] [ 1.74e-05 1.42e-05 9.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.96674752448e-15 -3.076179111936e-14 -8.010883104e-15 ] [ -8.8119714144e-15 8.010883104e-15 -1.938633711168e-14 ] [ -1.954655477376e-14 1.76239428288e-15 1.249697764224e-14 ] [ 5.28718284864e-15 -1.92261194496e-15 -4.8065298624e-16 ] [ 2.787787320192e-14 2.275090801536e-14 1.538089555968e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }