{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.7421245 3.4515493 0.0846361 ] [ -1.6569948 -1.3068812 0.4121797 ] [ -5.2124733 1.007918 0.3382349 ] [ -0.7644516 -2.7330048 -1.8631538 ] [ -0.6985905 -2.6322951 -3.3740232 ] [ 0.4662249 0.1889155 8.264423 ] [ 3.1241609 2.0237982 -3.8622968 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.59772100682289e-09 5.529991593998606e-09 1.356019806956909e-10 ] [ -2.654798329347172e-09 -2.093854504803049e-09 6.603846789083578e-10 ] [ -8.351302857804225e-09 1.614862655283495e-09 5.419120491186259e-10 ] [ -1.224786481253153e-09 -4.37875639509418e-09 -2.985101459314679e-09 ] [ -1.119265366612982e-09 -4.217401668266398e-09 -5.405781089076802e-09 ] [ 7.46974634814818e-10 3.026759974067424e-10 1.32410653150018e-08 ] [ 5.005457553597486e-09 3.242482161257122e-09 -6.188081635550654e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.705806 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.477653490882037e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4381659 1.6531761 2.8644366 ] [ 2.3649333 3.7416015 1.7014785 ] [ 1.9883899 3.5900938 4.232914 ] [ 3.2074933 1.3693277 1.2163856 ] [ 3.8682767 1.9570896 3.6227914 ] [ 4.851209 3.1308289 1.5663131 ] [ 4.0977699 4.5033243 3.4306327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4381659e-10 1.6531761e-10 2.8644366e-10 ] [ 2.3649333e-10 3.7416015e-10 1.7014785e-10 ] [ 1.9883899e-10 3.5900938e-10 4.232914e-10 ] [ 3.2074933e-10 1.3693277e-10 1.2163856e-10 ] [ 3.8682767e-10 1.9570896e-10 3.6227914e-10 ] [ 4.851209000000001e-10 3.1308289e-10 1.5663131e-10 ] [ 4.0977699e-10 4.5033243e-10 3.4306327e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.9e-06 -4.73e-05 -2.25e-05 ] [ -7.27e-05 8.68e-05 -4.43e-05 ] [ 2.54e-05 -1.55e-05 7.1e-06 ] [ -3.7e-05 -1.5e-05 -8e-07 ] [ 1.39e-05 5.7e-06 5.62e-05 ] [ 7.87e-05 -5.84e-05 -4.14e-05 ] [ -1.83e-05 4.37e-05 4.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.586154854592e-14 -7.578295416384e-14 -3.604897396800001e-14 ] [ -1.1647824033216e-13 1.3906893068544e-13 -7.097642430144e-14 ] [ 4.069528616832e-14 -2.48337376224e-14 1.137545400768e-14 ] [ -5.92805349696e-14 -2.4032649312e-14 -1.28174129664e-15 ] [ 2.227025502912e-14 9.13240673856e-15 9.004232608896e-14 ] [ 1.2609130005696e-13 -9.356711465472001e-14 -6.633011210111999e-14 ] [ -2.931983216064e-14 7.001511832895999e-14 7.305925390848e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937462138501e-18 } }