{ "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" [ [ 1.803671 2.545248 2.102248 ] [ 1.259758 2.236074 4.250707 ] [ 2.077592 4.735817 2.343172 ] [ 2.945146 3.702359 3.858992 ] [ 3.151976 1.102961 3.497539 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.803671e-10 2.545248e-10 2.102248e-10 ] [ 1.259758e-10 2.236074e-10 4.250707e-10 ] [ 2.077592e-10 4.735817000000001e-10 2.343172e-10 ] [ 2.945146e-10 3.702359e-10 3.858992e-10 ] [ 3.151976e-10 1.102961e-10 3.497539e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.026382 -1.919056 -1.8152749 ] [ -1.5953859 -1.6315369 2.0370196 ] [ -2.0730317 4.9403491 -4.5739724 ] [ 3.8759436 -1.9703521 4.6011468 ] [ -0.233908 0.5805959 -0.2489191 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.22686236099456e-11 -3.074666657205965e-09 -2.908391005105058e-09 ] [ -2.556089990133967e-09 -2.614010277152508e-09 3.263665179231367e-09 ] [ -3.321362923917279e-09 7.915311826610321e-09 -7.328311643464465e-09 ] [ 6.209946219459387e-09 -3.156852069364183e-09 7.371849831828734e-09 ] [ -3.747619290180864e-10 9.302171771123349e-10 -3.988123624905773e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.8182413992349495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.117497102424916e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6000279 2.5409432 2.1111245 ] [ 1.2139181 2.0057412 4.389078 ] [ 2.3021527 4.7720797 2.1026426 ] [ 2.9078719 3.6311392 4.0526096 ] [ 3.2141724 1.3725557 3.3972032 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6000279e-10 2.5409432e-10 2.1111245e-10 ] [ 1.2139181e-10 2.0057412e-10 4.389078e-10 ] [ 2.3021527e-10 4.7720797e-10 2.1026426e-10 ] [ 2.9078719e-10 3.6311392e-10 4.0526096e-10 ] [ 3.2141724e-10 1.3725557e-10 3.3972032e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.54e-05 -1.6e-06 1.76e-05 ] [ 1.7e-05 1.59e-05 -6.5e-06 ] [ -1.71e-05 5.01e-05 -2.84e-05 ] [ -1.74e-05 -2.1e-05 8.5e-06 ] [ 2e-06 -4.34e-05 8.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.467351996032e-14 -2.56348259328e-15 2.819830852608e-14 ] [ 2.72370025536e-14 2.547460827072e-14 -1.04141480352e-14 ] [ -2.739722021568e-14 8.026904870208e-14 -4.550181603071999e-14 ] [ -2.787787320192e-14 -3.36457090368e-14 1.36185012768e-14 ] [ 3.2043532416e-15 -6.953446534272e-14 1.393893660096e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.057896399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.103643361282738e-19 } }