{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3930755 0.6456526 -1.2128699 ] [ -3.7967509 -1.258805 4.6283399 ] [ -2.6314782 -1.811038 0.1024862 ] [ 1.3551796 -0.2550477 -2.7816954 ] [ 6.5366042 -3.6155107 -2.1764356 ] [ 0.1494136 4.8056525 2.912955 ] [ 1.7801073 1.4890963 -1.4727802 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.436306238709271e-09 1.034449500878734e-09 -1.943231797852034e-09 ] [ -6.083065526981359e-09 -2.016827941146144e-09 7.415417980895811e-09 ] [ -4.216092850184867e-09 -2.90160274298039e-09 1.64200993594633e-10 ] [ 2.171237072105096e-09 -4.086314621288121e-10 -4.456767336066905e-09 ] [ 1.047279442866309e-08 -5.792686715792242e-09 -3.48703423499682e-09 ] [ 2.393869767495629e-10 7.699504083189073e-09 4.667068398442464e-09 ] [ 2.852046298575412e-09 2.385795277979783e-09 -2.359654004017148e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.043472 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.250012251325942e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7973368 2.6571809 2.7556049 ] [ 2.5680583 0.8285749 5.7835658 ] [ 1.9555269 0.214078 3.4070234 ] [ 3.8438257 1.1833157 1.7834781 ] [ 4.5407688 0.5296371 4.1297745 ] [ 3.5663954 2.9131368 4.6926873 ] [ 4.1551951 3.6374791 2.313459 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7973368e-10 2.6571809e-10 2.7556049e-10 ] [ 2.5680583e-10 8.285749e-11 5.7835658e-10 ] [ 1.9555269e-10 2.14078e-11 3.4070234e-10 ] [ 3.8438257e-10 1.1833157e-10 1.7834781e-10 ] [ 4.540768800000001e-10 5.296371e-11 4.1297745e-10 ] [ 3.5663954e-10 2.9131368e-10 4.6926873e-10 ] [ 4.1551951e-10 3.637479100000001e-10 2.313459e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.4e-06 2.3e-05 1.45e-05 ] [ 2.5e-06 -5.6e-06 -1.41e-05 ] [ -3.8e-06 -2.3e-06 8e-07 ] [ 2.2e-06 -6.1e-06 3.9e-06 ] [ 1.2e-05 4.6e-06 1.3e-05 ] [ -1.24e-05 -7.5e-06 -1.28e-05 ] [ -4.9e-06 -6e-06 -5.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.04957713152e-15 3.68500622784e-14 2.32315610016e-14 ] [ 4.005441552e-15 -8.972189076479999e-15 -2.259069035328e-14 ] [ -6.08827115904e-15 -3.68500622784e-15 1.28174129664e-15 ] [ 3.52478856576e-15 -9.77327738688e-15 6.24848882112e-15 ] [ 1.92261194496e-14 7.370012455680001e-15 2.08282960704e-14 ] [ -1.986699009792e-14 -1.2016324656e-14 -2.050786074624e-14 ] [ -7.850665441919999e-15 -9.6130597248e-15 -8.65175375232e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.527058 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.647926593820561e-18 } }