{ "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" [ [ 0.6628403 2.876785 2.898563 ] [ 2.674482 0.2424727 1.042802 ] [ 2.274992 1.1385 2.859862 ] [ 1.854823 2.68523 0.2527791 ] [ 2.130586 2.70202 1.965626 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.628403e-11 2.876785e-10 2.898563e-10 ] [ 2.674482e-10 2.424727e-11 1.042802e-10 ] [ 2.274992e-10 1.1385e-10 2.859862e-10 ] [ 1.854823e-10 2.68523e-10 2.527791e-11 ] [ 2.130586e-10 2.70202e-10 1.965626e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -18.2943972 13.5228351 4.0017905 ] [ 0.3549619 -2.27398 -5.2857683 ] [ 11.7912316 -19.3452241 5.0092384 ] [ 0.0945771 -4.9708554 -3.6705981 ] [ 6.0536266 13.0672244 -0.0546624 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.931085572695502e-08 2.166597042265505e-08 6.411575233263177e-09 ] [ 5.687116621402445e-10 -3.643317622183319e-09 -8.468734462997901e-09 ] [ 1.889163575560243e-08 -3.099446603251367e-08 8.025684718615545e-09 ] [ 1.515292197314814e-10 -7.964188372872723e-09 -5.880946508624795e-09 ] [ 9.698979089480863e-09 2.093600160491467e-08 -8.75788200383616e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -3.6144026 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.790911391588848e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1107837 3.4661778 3.0963633 ] [ 2.6233194 0.4121281 0.7872716 ] [ 2.7876177 0.6053861 3.1500292 ] [ 1.9861954 2.4781492 -0.1989452 ] [ 2.0898071 2.6831665 2.1849132 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.107837e-11 3.4661778e-10 3.0963633e-10 ] [ 2.6233194e-10 4.121281e-11 7.872716e-11 ] [ 2.787617700000001e-10 6.053861e-11 3.1500292e-10 ] [ 1.9861954e-10 2.4781492e-10 -1.989452e-11 ] [ 2.0898071e-10 2.6831665e-10 2.1849132e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.84e-05 -3.55e-05 -3.8e-05 ] [ -4.14e-05 6.06e-05 -1.05e-05 ] [ 5.7e-06 4.86e-05 1.05e-05 ] [ 2.59e-05 -1.48e-05 3.6e-05 ] [ -6.87e-05 -5.89e-05 2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.256106481056e-13 -5.6877270507e-14 -6.088271209199999e-14 ] [ -6.633011264759999e-14 9.709190402039998e-14 -1.6822854657e-14 ] [ 9.1324068138e-15 7.786578441239999e-14 1.6822854657e-14 ] [ 4.149637482059999e-14 -2.37122141832e-14 5.7678358824e-14 ] [ -1.100695347558e-13 -9.436820374259999e-14 3.204353268e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.551871 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.331466769718221e-18 } }