{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.032434 0.1172693 0.4247075 ] [ 0.2432392 0.0735251 2.276612 ] [ 0.5624588 1.720194 2.530042 ] [ 2.331345 1.198395 0.9085221 ] [ 2.704395 0.5611016 2.497073 ] [ 2.283372 2.154556 2.294867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032434e-10 1.172693e-11 4.247075e-11 ] [ 2.432392e-11 7.35251e-12 2.276612e-10 ] [ 5.624588000000001e-11 1.720194e-10 2.530042e-10 ] [ 2.331345e-10 1.198395e-10 9.085221e-11 ] [ 2.704395e-10 5.611016e-11 2.497073e-10 ] [ 2.283372e-10 2.154556e-10 2.294867e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9481516 -1.5615603 -2.7960812 ] [ -1.2715514 -2.3106188 1.9618902 ] [ -2.2119364 1.9218266 0.9185837 ] [ 1.9874331 1.0276386 -4.1062699 ] [ 0.9844559 -3.1822554 2.3813308 ] [ 1.4597504 4.1049694 1.6405465 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.519106326494113e-09 -2.501895404629434e-09 -4.47981592849841e-09 ] [ -2.037249925225509e-09 -3.702019420940951e-09 3.143294611016636e-09 ] [ -3.543912786776517e-09 3.079105647751553e-09 1.471733328387961e-09 ] [ 3.184218848224069e-09 1.646458539551643e-09 -6.578969632474753e-09 ] [ 1.577272227188623e-09 -5.098535203294553e-09 3.815312534150961e-09 ] [ 2.338777963083449e-09 6.576886001779404e-09 2.628445247635267e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.144848 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.465166166636964e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.878297 -0.0154404 0.1760855 ] [ 0.3389329 -0.1757048 2.3848093 ] [ 0.1867704 2.0388637 2.9021069 ] [ 2.8056613 1.1752035 0.4840386 ] [ 2.6108405 0.2339553 2.6525127 ] [ 2.3367419 2.5681636 2.3322707 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.78297e-11 -1.54404e-12 1.760855e-11 ] [ 3.389329e-11 -1.757048e-11 2.3848093e-10 ] [ 1.867704e-11 2.0388637e-10 2.9021069e-10 ] [ 2.8056613e-10 1.1752035e-10 4.840386e-11 ] [ 2.6108405e-10 2.339553e-11 2.6525127e-10 ] [ 2.3367419e-10 2.5681636e-10 2.3322707e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 -1.57e-05 2.75e-05 ] [ -7.89e-05 -1.79e-05 -4.1e-06 ] [ 9.2e-06 2.54e-05 -2.23e-05 ] [ 1.1e-05 5.85e-05 -1.65e-05 ] [ 7.97e-05 -4.34e-05 2.13e-05 ] [ -1.74e-05 -6.8e-06 -5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.928053496960001e-15 -2.515417294656e-14 4.4059857072e-14 ] [ -1.2641173538112e-13 -2.867896151232001e-14 -6.568924145279999e-15 ] [ 1.474002491136e-14 4.069528616832e-14 -3.572853864384e-14 ] [ 1.76239428288e-14 9.37273323168e-14 -2.64359142432e-14 ] [ 1.2769347667776e-13 -6.953446534272e-14 3.412636202304e-14 ] [ -2.787787320192e-14 -1.089480102144e-14 -9.45284206272e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.483636 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961404946657723e-18 } }