{ "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" [ [ 2.114 2.095272 1.915779 ] [ 2.14246 0.9228837 3.956719 ] [ 3.791491 3.03012 0.940196 ] [ 4.524648 0.3016751 5.057567 ] [ 3.666195 2.4276 3.537085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.114e-10 2.095272e-10 1.915779e-10 ] [ 2.14246e-10 9.228837e-11 3.956719e-10 ] [ 3.791491000000001e-10 3.03012e-10 9.40196e-11 ] [ 4.524648e-10 3.016751e-11 5.057567e-10 ] [ 3.666195e-10 2.4276e-10 3.537085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8742237 -1.4736425 -3.4886837 ] [ -0.3979694 -4.198503 2.7904882 ] [ 2.2553877 0.7708454 -1.2886041 ] [ -3.0639335 1.9130209 -2.5166554 ] [ 7.080739 2.9882792 4.5034549 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.411543877489273e-09 -2.361035560917264e-09 -5.589487461506042e-09 ] [ -6.376172684738034e-10 -6.726743348958662e-09 4.470854954658275e-09 ] [ 3.613529443779885e-09 1.235030478131224e-09 -2.064571362487025e-09 ] [ -4.908962621385917e-09 3.064997361081775e-09 -4.032126444490072e-09 ] [ 1.134459448378677e-08 4.787751070662928e-09 7.215330153607203e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.9020716 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.266051437340765e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9814643 1.8903252 1.2548342 ] [ 2.1002149 0.8282296 4.1147007 ] [ 3.4776179 3.0009224 1.2499705 ] [ 4.2076435 0.4693878 4.6808507 ] [ 4.4718533 2.5886858 4.1069899 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9814643e-10 1.8903252e-10 1.2548342e-10 ] [ 2.1002149e-10 8.282296000000001e-11 4.1147007e-10 ] [ 3.4776179e-10 3.0009224e-10 1.2499705e-10 ] [ 4.2076435e-10 4.693878e-11 4.680850699999999e-10 ] [ 4.471853300000001e-10 2.5886858e-10 4.1069899e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.15e-05 3.86e-05 -3.5e-06 ] [ 4.2e-06 -1.22e-05 -9.9e-06 ] [ -4.04e-05 -2.19e-05 -1.6e-06 ] [ -5e-07 -2e-06 3.21e-05 ] [ 5.2e-06 -2.5e-06 -1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.04685635552e-14 6.184401756288e-14 -5.6076181728e-15 ] [ 6.72914180736e-15 -1.954655477376e-14 -1.586154854592e-14 ] [ -6.472793548032e-14 -3.508766799552e-14 -2.56348259328e-15 ] [ -8.010883104e-16 -3.2043532416e-15 5.142986952768e-14 ] [ 8.33131842816e-15 -4.005441552e-15 -2.739722021568e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.919261 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.031199765701323e-18 } }