{ "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" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4487625 -2.8319414 -0.0269535 ] [ 1.9716114 3.1415906 0.2762958 ] [ -0.5355425 -1.2227853 -1.7510544 ] [ -12.8179209 -1.1865604 2.0687642 ] [ 7.8720047 -7.376797 -2.5145677 ] [ 6.5800544 6.4836759 0.1777182 ] [ -0.6214446 2.9928176 1.7697973 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.923350059715425e-09 -4.537270339937247e-09 -4.318426790451899e-11 ] [ 3.158869716408027e-09 5.03338305291404e-09 4.426746748323371e-10 ] [ -8.580336800139451e-10 -1.95911803605868e-09 -2.805498444542889e-09 ] [ -2.053657336244025e-08 -1.901079347709694e-09 3.314525662495703e-09 ] [ 1.261234199307818e-08 -1.18189317871613e-08 -4.028781613551122e-09 ] [ 1.054240941012889e-08 1.038799402940892e-08 2.847359474765388e-10 ] [ -9.956640174454762e-10 4.795022428543958e-09 2.835527880976288e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7090013 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.555553502233562e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.12052 1.5915175 3.8134119 ] [ 2.2462964 4.7613788 2.0159923 ] [ 2.8089018 2.9259895 0.3472297 ] [ 0.7346314 3.4567395 3.2788683 ] [ 4.0026189 1.9703705 2.3606764 ] [ 4.2069891 4.2185412 3.3769057 ] [ 2.9263694 3.4886998 5.4381106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.12052e-10 1.5915175e-10 3.8134119e-10 ] [ 2.2462964e-10 4.7613788e-10 2.0159923e-10 ] [ 2.8089018e-10 2.9259895e-10 3.472297e-11 ] [ 7.346314000000001e-11 3.4567395e-10 3.2788683e-10 ] [ 4.0026189e-10 1.9703705e-10 2.3606764e-10 ] [ 4.206989100000001e-10 4.2185412e-10 3.3769057e-10 ] [ 2.9263694e-10 3.4886998e-10 5.4381106e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.78e-05 -0.0001044 -1.93e-05 ] [ -5.6e-06 -2.52e-05 2.49e-05 ] [ -3.7e-06 2.77e-05 3.4e-06 ] [ 6.19e-05 5.01e-05 2.72e-05 ] [ -2.31e-05 -1.64e-05 5.3e-06 ] [ 3.1e-06 5.4e-06 -1.6e-05 ] [ -6.04e-05 6.28e-05 -2.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.454051042519999e-14 -1.672672405896e-13 -3.09220090362e-14 ] [ -8.972189150399999e-15 -4.037485117679999e-14 3.989419818659999e-14 ] [ -5.9280535458e-15 4.438029276179999e-14 5.4474005556e-15 ] [ 9.917473364459999e-14 8.026904936339999e-14 4.35792044448e-14 ] [ -3.70102802454e-14 -2.62756967976e-14 8.4915361602e-15 ] [ 4.9667475654e-15 8.6517538236e-15 -2.5634826144e-14 ] [ -9.677146869359998e-14 1.006166926152e-13 -4.0855504167e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.891963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.026826168899254e-18 } }