{ "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" [ [ 2.360944 2.643853 2.165766 ] [ 2.694587 4.80447 3.102481 ] [ 4.665525 1.923814 2.374826 ] [ 4.545146 3.928705 1.722535 ] [ 3.943017 3.203445 4.218269 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.360944e-10 2.643853e-10 2.165766e-10 ] [ 2.694587e-10 4.80447e-10 3.102481e-10 ] [ 4.665525e-10 1.923814e-10 2.374826e-10 ] [ 4.545146e-10 3.928705e-10 1.722535e-10 ] [ 3.943017e-10 3.203445e-10 4.218269e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.3326613 -6.3765415 -4.8254305 ] [ -0.8019375 2.9768965 0.2978165 ] [ -1.0154395 2.2298897 1.7683785 ] [ 7.8252672 4.8668664 -10.2101391 ] [ 3.3247711 -3.6971111 12.9693746 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.495257174470494e-08 -1.021634571286096e-08 -7.731191932395255e-09 ] [ -1.2848455138428e-09 4.769513974841348e-09 4.771546335884832e-10 ] [ -1.626913426736842e-09 3.572677144302726e-09 2.833254689425373e-09 ] [ 1.253746015935308e-08 7.797579562637062e-09 -1.635844616113595e-08 ] [ 5.3268705259315e-09 -5.923424968920171e-09 2.077922877051735e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.7619911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.629550808877676e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9456864 2.3882895 2.0033153 ] [ 2.8179827 4.619574 2.9886605 ] [ 4.4657013 1.9821366 2.4449012 ] [ 4.8699885 4.3326285 1.4338625 ] [ 4.1098601 3.1816583 4.7131375 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9456864e-10 2.3882895e-10 2.0033153e-10 ] [ 2.8179827e-10 4.619574e-10 2.9886605e-10 ] [ 4.465701300000001e-10 1.9821366e-10 2.4449012e-10 ] [ 4.8699885e-10 4.3326285e-10 1.4338625e-10 ] [ 4.1098601e-10 3.1816583e-10 4.713137500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 1.9e-06 1.8e-06 ] [ 1.78e-05 -1.9e-05 -1.52e-05 ] [ -8.7e-06 2.5e-05 -2.8e-06 ] [ -5.4e-06 8e-07 -1.02e-05 ] [ -3.6e-06 -8.7e-06 2.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 3.04413557952e-15 2.88391791744e-15 ] [ 2.851874385024e-14 -3.04413557952e-14 -2.435308463616e-14 ] [ -1.393893660096e-14 4.005441552e-14 -4.48609453824e-15 ] [ -8.65175375232e-15 1.28174129664e-15 -1.634220153216e-14 ] [ -5.76783583488e-15 -1.393893660096e-14 4.229746278912e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.025254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.926658081798169e-18 } }