{ "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" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6444229 -7.7470586 1.9004266 ] [ -5.975642 6.327335 -4.9543704 ] [ -3.6535864 3.4556561 5.906981 ] [ 5.4112332 -4.1163929 -8.8748651 ] [ 12.8624182 2.0804605 6.021828 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.384989238479452e-08 -1.241215627114875e-08 3.044819093152064e-09 ] [ -9.574033985549027e-09 1.013750829249039e-08 -7.937776491061233e-09 ] [ -5.853690760380177e-09 5.536571458559567e-09 9.464026935681953e-09 ] [ 8.669751394165047e-09 -6.595188520743499e-09 -1.421910149312207e-08 ] [ 2.060786589677634e-08 3.333265201059957e-09 9.648032115566952e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.441271 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.911347353461814e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6059721 1.6847543 1.784455 ] [ 2.8426396 3.834306 1.4623506 ] [ 2.5818262 3.9900033 3.9445609 ] [ 4.5329023 2.0676715 0.4661589 ] [ 5.3496558 3.9973628 2.2738901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6059721e-10 1.6847543e-10 1.784455e-10 ] [ 2.8426396e-10 3.834306e-10 1.4623506e-10 ] [ 2.5818262e-10 3.9900033e-10 3.9445609e-10 ] [ 4.5329023e-10 2.0676715e-10 4.661589e-11 ] [ 5.3496558e-10 3.9973628e-10 2.2738901e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.47e-05 -6.3e-06 1.5e-06 ] [ 6.55e-05 -3.06e-05 4.71e-05 ] [ -3.19e-05 2.32e-05 -1.91e-05 ] [ -1.65e-05 5.99e-05 1.59e-05 ] [ -3.19e-05 -4.62e-05 -4.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.35519965198e-14 -1.00937127942e-14 2.403264951e-15 ] [ 1.04942569527e-13 -4.90266050004e-14 7.546251946139999e-14 ] [ -5.11094346246e-14 3.71704979088e-14 -3.06015737094e-14 ] [ -2.6435914461e-14 9.597038037659999e-14 2.54746084806e-14 ] [ -5.11094346246e-14 -7.40205604908e-14 -7.289903684699999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.063522 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.772571643814495e-18 } }