{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.4792648 -11.6228572 -0.9955924 ] [ -2.3065418 0.9605465 0.3345529 ] [ 29.2580485 -29.8220253 -26.0865679 ] [ 20.3480357 2.7466162 36.9094889 ] [ -29.8202777 37.7377198 -10.1618814 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.800486941133239e-08 -1.862187007273695e-08 -1.595114867126162e-09 ] [ -3.695487346857949e-09 1.538965145491267e-09 5.360128348008402e-10 ] [ 4.687656127693251e-08 -4.77801517205661e-08 -4.179528920629175e-08 ] [ 3.260114707774376e-08 4.400564261950536e-09 5.913552020125711e-08 ] [ -4.777735175670359e-08 6.046249238586125e-08 -1.628112880242238e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 8.7352265 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.399537567569261e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7864879 0.3139061 1.8529721 ] [ -0.5070056 2.2887046 1.5350529 ] [ 2.4315366 0.1697219 0.0119618 ] [ 3.1394097 0.9870332 2.2092848 ] [ 1.74156 2.4235617 0.7605924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.864879000000001e-11 3.139061e-11 1.8529721e-10 ] [ -5.070056e-11 2.2887046e-10 1.5350529e-10 ] [ 2.4315366e-10 1.697219e-11 1.19618e-12 ] [ 3.1394097e-10 9.870332000000001e-11 2.2092848e-10 ] [ 1.74156e-10 2.4235617e-10 7.605924e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.9e-05 -1.77e-05 -2.6e-06 ] [ 7.9e-06 8.2e-06 3.08e-05 ] [ 2.77e-05 7e-07 -3.2e-06 ] [ -1.49e-05 1.44e-05 8e-07 ] [ 8.2e-06 -5.7e-06 -2.58e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.64631220032e-14 -2.835852618816e-14 -4.16565921408e-15 ] [ 1.265719530432e-14 1.313784829056e-14 4.934703992064001e-14 ] [ 4.438029239616e-14 1.12152363456e-15 -5.126965186560001e-15 ] [ -2.387243164992e-14 2.307134333952e-14 1.28174129664e-15 ] [ 1.313784829056e-14 -9.13240673856e-15 -4.133615681664e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.106817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.260161239130399e-18 } }