{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.407843 0.245212 0.8461342 ] [ 0.3575484 2.529829 0.7913405 ] [ 2.613551 0.2346879 2.890384 ] [ 2.035903 2.65608 2.375902 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.407843e-10 2.45212e-11 8.461342e-11 ] [ 3.575484e-11 2.529829e-10 7.913405e-11 ] [ 2.613551e-10 2.346879e-11 2.890384e-10 ] [ 2.035903e-10 2.65608e-10 2.375902e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4970529 -0.0891638 -0.2471819 ] [ 0.5439283 -0.9722677 0.0687419 ] [ -0.5006221 1.1322635 -0.6906369 ] [ 0.4537468 -0.070832 0.8690769 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.963665356808404e-10 -1.42856155781687e-10 -3.960290612649235e-10 ] [ 8.714692056514888e-10 -1.557744578098988e-09 1.101366650493715e-10 ] [ -8.020850244757997e-10 1.814086108285181e-09 -1.106522294641788e-09 ] [ 7.269825147228135e-10 -1.134853744045056e-10 1.39241469085734e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8606953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.389868991292443e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2060667 0.1223112 0.8323255 ] [ 0.6366248 2.3445341 0.812224 ] [ 2.5707729 0.4883636 2.6396777 ] [ 2.001381 2.7106 2.6195335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2060667e-10 1.223112e-11 8.323255e-11 ] [ 6.366248e-11 2.3445341e-10 8.12224e-11 ] [ 2.5707729e-10 4.883636e-11 2.6396777e-10 ] [ 2.001381e-10 2.7106e-10 2.6195335e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.9e-06 3.44e-05 3.62e-05 ] [ 3.88e-05 -3.05e-05 3.4e-06 ] [ -1.51e-05 4.47e-05 -4.02e-05 ] [ -1.59e-05 -4.86e-05 6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.265719530432e-14 5.511487575552001e-14 5.799879367296e-14 ] [ 6.216445288704e-14 -4.88663869344e-14 5.44740051072e-15 ] [ -2.419286697408e-14 7.161729494976001e-14 -6.440750015616e-14 ] [ -2.547460827072e-14 -7.786578377088e-14 9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -6.5960346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.056801242610788e-18 } }