{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3422565 2.3723868 -3.6423747 ] [ -3.2034609 -1.759998 4.5027939 ] [ -1.1142194 -0.5699739 1.045625 ] [ 0.377998 0.4709047 -1.8450461 ] [ 7.5343454 -4.6834531 -1.5660934 ] [ -0.6373651 3.815392 2.4523757 ] [ 1.3849584 0.3547416 -0.9472804 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.957061903134621e-09 3.800982697770031e-09 -5.835727636612759e-09 ] [ -5.13251020191261e-09 -2.819827671486732e-09 7.214271174297733e-09 ] [ -1.7851762878295e-09 -9.131988645698526e-10 1.67527594292625e-09 ] [ 6.056195632987319e-10 7.544725071807798e-10 -2.956089750072827e-09 ] [ 1.207135215236538e-08 -7.503719123254865e-09 -2.509158252141615e-09 ] [ -1.021171470547073e-09 6.112931911950528e-09 3.929139044329394e-09 ] [ 2.218947987542025e-09 5.683587026277743e-10 -1.517710522726174e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.937442 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.873895044613023e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9055862 2.7401292 2.4589003 ] [ 2.8811464 0.707669 5.8896434 ] [ 2.053945 0.5761477 3.5678251 ] [ 3.7778182 1.1266763 1.7268933 ] [ 4.5032695 0.4274502 4.0814367 ] [ 3.1308333 2.8601796 4.718093 ] [ 4.1745084 3.5251503 2.4228011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9055862e-10 2.7401292e-10 2.4589003e-10 ] [ 2.8811464e-10 7.07669e-11 5.8896434e-10 ] [ 2.053945e-10 5.761477000000001e-11 3.5678251e-10 ] [ 3.7778182e-10 1.1266763e-10 1.7268933e-10 ] [ 4.5032695e-10 4.274502e-11 4.081436700000001e-10 ] [ 3.1308333e-10 2.8601796e-10 4.718093e-10 ] [ 4.1745084e-10 3.5251503e-10 2.4228011e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0001228 -4.8e-06 -1.14e-05 ] [ 3.13e-05 2.2e-06 -1.9e-06 ] [ -5.3e-05 6.3e-06 4.77e-05 ] [ 1.44e-05 1.05e-05 -0.0001073 ] [ -1.64e-05 -3.16e-05 6.71e-05 ] [ -2.16e-05 -2.13e-05 2.52e-05 ] [ -7.75e-05 3.85e-05 -1.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.967472906552e-13 -7.690447843199998e-15 -1.82648136276e-14 ] [ 5.014812864419999e-14 3.5247885948e-15 -3.0441356046e-15 ] [ -8.491536160199999e-14 1.00937127942e-14 7.64238254418e-14 ] [ 2.30713435296e-14 1.6822854657e-14 -1.719135528282e-13 ] [ -2.62756967976e-14 -5.06287816344e-14 1.075060521414e-13 ] [ -3.46070152944e-14 -3.41263623042e-14 4.037485117679999e-14 ] [ -1.24168689135e-13 6.168380040899999e-14 -3.10822266996e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.361861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.422547455295587e-18 } }