{ "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" [ [ 0.489786 0.6379758 2.385139 ] [ 2.264964 0.0865491 0.9234604 ] [ 2.944507 2.806058 0.1090737 ] [ 1.576252 2.005156 0.0788695 ] [ 2.792909 2.291732 2.895835 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.89786e-11 6.379758e-11 2.385139e-10 ] [ 2.264964e-10 8.654910000000001e-12 9.234604e-11 ] [ 2.944507e-10 2.806058e-10 1.090737e-11 ] [ 1.576252e-10 2.005156e-10 7.88695e-12 ] [ 2.792909e-10 2.291732e-10 2.895835e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7702217 0.9113905 0.631691 ] [ 0.181207 -0.7612526 1.2635007 ] [ 8.6914016 4.993929 2.6653932 ] [ -8.8693107 -3.8013268 -1.0028134 ] [ -1.7735197 -1.34274 -3.5577714 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.836207844739758e-09 1.460208563549577e-09 1.012080560108094e-09 ] [ 2.90325621317238e-10 -1.219661128291748e-09 2.024351298582644e-09 ] [ 1.392516056023021e-08 8.001156355654985e-09 4.270430705462489e-09 ] [ -1.421020236322618e-08 -6.09039697715799e-09 -1.606684197742096e-09 ] [ -2.84149182327869e-09 -2.15130665353716e-09 -5.700178206193467e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.685611332689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.071153026124099e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8726065 0.8493597 2.1049569 ] [ 2.7414028 -0.019807 0.9095462 ] [ 3.1547579 2.2816328 0.4519938 ] [ 0.787127 2.2592567 0.1861767 ] [ 2.5125237 2.4570287 2.7397039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.726065e-11 8.493597e-11 2.1049569e-10 ] [ 2.7414028e-10 -1.9807e-12 9.095462e-11 ] [ 3.1547579e-10 2.2816328e-10 4.519938e-11 ] [ 7.87127e-11 2.2592567e-10 1.861767e-11 ] [ 2.5125237e-10 2.4570287e-10 2.7397039e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.72e-05 -4.75e-05 2.03e-05 ] [ 5.1e-06 -4.87e-05 -7e-06 ] [ 4.23e-05 2.23e-05 -1.85e-05 ] [ -3.38e-05 2.94e-05 -2.55e-05 ] [ 1.35e-05 4.44e-05 3.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.35792044448e-14 -7.6103390115e-14 3.252418567019999e-14 ] [ 8.1711008334e-15 -7.802600207579999e-14 -1.1215236438e-14 ] [ 6.77720716182e-14 3.572853893819999e-14 -2.9640267729e-14 ] [ -5.415357022919999e-14 4.710399303959999e-14 -4.0855504167e-14 ] [ 2.162938455899999e-14 7.11366425496e-14 4.93470403272e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }