{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.144626 2.611578 2.318929 ] [ 1.72687 4.93899 1.794824 ] [ 4.392296 1.543553 2.156587 ] [ 3.81892 4.173373 2.152355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.144626e-10 2.611578e-10 2.318929e-10 ] [ 1.72687e-10 4.93899e-10 1.794824e-10 ] [ 4.392296e-10 1.543553e-10 2.156587e-10 ] [ 3.81892e-10 4.173373e-10 2.152355e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2031327 -0.562484 -0.025146 ] [ -0.5004527 -0.1117572 -0.0765479 ] [ -1.0374364 1.4864574 0.0106906 ] [ 1.3347564 -0.8122161 0.0910033 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.254544628599801e-10 -9.011987143740672e-10 -4.02883333066368e-11 ] [ -8.018136157562361e-10 -1.790547730460697e-10 -1.226432557513363e-10 ] [ -1.662156345646917e-09 2.381567294095154e-09 1.712822938232448e-11 ] [ 2.138515498543173e-09 -1.301313646457355e-09 1.458033596756487e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.0335216 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.447329711101181e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7602896 2.2884644 2.2161063 ] [ 1.9863769 4.5693809 1.9650578 ] [ 4.0549787 2.0643605 2.2462487 ] [ 4.2810668 4.3452882 1.9952822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7602896e-10 2.2884644e-10 2.2161063e-10 ] [ 1.9863769e-10 4.5693809e-10 1.9650578e-10 ] [ 4.054978700000001e-10 2.0643605e-10 2.2462487e-10 ] [ 4.2810668e-10 4.3452882e-10 1.9952822e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9e-07 -1.47e-05 -9.7e-06 ] [ 3e-07 2.53e-05 8.5e-06 ] [ 8.1e-06 -4.4e-06 1.18e-05 ] [ -9.2e-06 -6.2e-06 -1.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.44195895872e-15 -2.355199632576e-14 -1.554111322176e-14 ] [ 4.8065298624e-16 4.053506850624e-14 1.36185012768e-14 ] [ 1.297763062848e-14 -7.04957713152e-15 1.890568412544e-14 ] [ -1.474002491136e-14 -9.93349504896e-15 -1.714328984256e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.6673908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.548886752389701e-18 } }