{ "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" [ [ 0.2609343 1.090408 2.782185 ] [ 0.9561081 2.831858 1.606096 ] [ 1.573969 0.2926919 1.087299 ] [ 2.9831 1.515461 0.0011433 ] [ 2.828068 2.074027 2.745594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.609343e-11 1.090408e-10 2.782185e-10 ] [ 9.561081000000001e-11 2.831858e-10 1.606096e-10 ] [ 1.573969e-10 2.926919e-11 1.087299e-10 ] [ 2.9831e-10 1.515461e-10 1.1433e-13 ] [ 2.828068e-10 2.074027e-10 2.745594e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9751761 -1.0810112 1.9995748 ] [ 4.3768148 -0.9776529 -4.009856 ] [ -2.4507729 -1.1338391 2.5574694 ] [ -0.171501 5.108317 2.6916845 ] [ -2.7297171 -1.9158137 -3.2388728 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.562404348582923e-09 -1.731970871462953e-09 3.203671996100836e-09 ] [ 7.012430346131429e-09 -1.56637261963732e-09 -6.424497535974605e-09 ] [ -3.926571043270216e-09 -1.816610497768913e-09 4.097517681091404e-09 ] [ -2.747748926438208e-10 8.184426069035194e-09 4.312553976469738e-09 ] [ -4.373488919017976e-09 -3.069471919948345e-09 -5.189246277905035e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.551926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.812128548721166e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4284899 1.2351538 3.0234252 ] [ 0.9897535 2.631605 1.2128106 ] [ 1.4824369 0.3185919 1.1280301 ] [ 3.0123818 1.8866241 0.2655014 ] [ 2.6891174 1.7324712 2.5925499 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.284899e-11 1.2351538e-10 3.0234252e-10 ] [ 9.897535e-11 2.631605e-10 1.2128106e-10 ] [ 1.4824369e-10 3.185919e-11 1.1280301e-10 ] [ 3.0123818e-10 1.8866241e-10 2.655014e-11 ] [ 2.689117400000001e-10 1.7324712e-10 2.5925499e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.6e-06 5.4e-06 1.2e-06 ] [ 6.5e-06 -5.9e-06 8.4e-06 ] [ -4.8e-06 -1.24e-05 -7.3e-06 ] [ 1.7e-06 4.6e-06 3.5e-06 ] [ -8e-07 8.2e-06 -5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.16565921408e-15 8.65175375232e-15 1.92261194496e-15 ] [ 1.04141480352e-14 -9.45284206272e-15 1.345828361472e-14 ] [ -7.69044777984e-15 -1.986699009792e-14 -1.169588933184e-14 ] [ 2.72370025536e-15 7.370012455680001e-15 5.6076181728e-15 ] [ -1.28174129664e-15 1.313784829056e-14 -9.13240673856e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245481754911e-18 } }