{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.614856e-11 4.953887e-11 2.7731316e-10 ] [ 4.017529000000001e-11 2.4826368e-10 1.5458371e-10 ] [ 1.4299276e-10 1.2780914e-10 -1.721733e-11 ] [ 2.374273e-10 -1.2879e-12 1.5313617e-10 ] [ 3.6971386e-10 1.6088122e-10 2.4018896e-10 ] [ 2.2921475e-10 3.3909788e-10 2.4053422e-10 ] ] "source-value" [ [ 0.4614856 0.4953887 2.7731316 ] [ 0.4017529 2.4826368 1.5458371 ] [ 1.4299276 1.2780914 -0.1721733 ] [ 2.374273 -0.012879 1.5313617 ] [ 3.6971386 1.6088122 2.4018896 ] [ 2.2921475 3.3909788 2.4053422 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.32387854176704e-12 2.9624245718592e-13 2.77625164852224e-12 ] [ -4.18392402755712e-12 4.971874489666561e-12 -3.69750320548224e-12 ] [ 3.2075575948416e-12 -3.5936821604544e-13 1.04574068039616e-12 ] [ 1.72266030268416e-12 -4.953129023203199e-12 5.335248147264e-13 ] [ 3.140266176768e-12 -4.021463318208e-13 -5.497708856613119e-12 ] [ -2.56252128730752e-12 4.4636640655488e-13 4.83969491845056e-12 ] ] "source-value" [ [ -0.0008263 0.0001849 0.0017328 ] [ -0.0026114 0.0031032 -0.0023078 ] [ 0.002002 -0.0002243 0.0006527 ] [ 0.0010752 -0.0030915 0.000333 ] [ 0.00196 -0.000251 -0.0034314 ] [ -0.0015994 0.0002786 0.0030207 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.831899268172898e-18 "source-value" -11.433816 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.892651714510116e-08 -2.570838907125572e-08 3.288706959487978e-08 ] [ -4.015886349673956e-08 3.78263987504127e-08 -1.772417339602063e-08 ] [ -1.629756969803437e-09 -3.352697493178576e-09 -4.560381732354194e-08 ] [ 1.364284538924708e-08 -6.070365185060641e-08 8.355432147609012e-09 ] [ 6.168069456207358e-08 1.709113498811141e-08 -1.035494328318456e-08 ] [ 5.391597660323508e-09 3.484720467651659e-08 3.244043226025833e-08 ] ] "source-value" [ [ -24.2960212 -16.0459145 20.5264945 ] [ -25.0651913 23.6093813 -11.062559 ] [ -1.0172143 -2.0925892 -28.4636642 ] [ 8.5151944 -37.8882397 5.2150506 ] [ 38.4980618 10.6674475 -6.4630473 ] [ 3.3651706 21.7499146 20.2477254 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 3.700482132473293e-18 "source-value" 23.096593 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.353879e-11 9.970923e-11 2.660459e-10 ] [ 8.434423e-11 2.30713e-10 1.528251e-10 ] [ 1.912844e-10 1.041012e-10 8.271393e-12 ] [ 2.263312e-10 2.132627e-11 1.656325e-10 ] [ 2.91731e-10 1.870919e-10 1.650254e-10 ] [ 2.184429e-10 2.813613e-10 2.907386e-10 ] ] "source-value" [ [ 0.5353879 0.9970923 2.660459 ] [ 0.8434423 2.30713 1.528251 ] [ 1.912844 1.041012 0.08271393 ] [ 2.263312 0.2132627 1.656325 ] [ 2.91731 1.870919 1.650254 ] [ 2.184429 2.813613 2.907386 ] ] } "instance-id" 1 }