{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.5778543 0.3695564 -1.4415159 ] [ -0.9356446 2.1748699 1.3238918 ] [ -0.1173041 -2.7054475 0.0226119 ] [ 0.0047576 1.5761929 0.3082315 ] [ -3.0517705 -0.281062 2.5752738 ] [ 0.3478727 -0.5244397 -0.5126316 ] [ 1.1742348 -0.6096701 -2.2758616 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.130177925316426e-09 5.920946290251575e-10 -2.30956309251948e-09 ] [ -1.499067915848276e-09 3.484525735769916e-09 2.121108507904201e-09 ] [ -1.879418880923994e-10 -4.334604769013714e-09 3.62282578303446e-11 ] [ 7.622515553918398e-12 2.525339435056698e-09 4.938413071627709e-10 ] [ -4.889475387430496e-09 -4.503109691053079e-10 4.126043508512389e-09 ] [ 5.573535115464917e-10 -8.402450332819696e-10 -8.213263713700343e-10 ] [ 1.881331559389663e-09 -9.767991886684434e-10 -3.646332277737853e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.65465606491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.668370079451543e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.568006 2.4972741 2.0021981 ] [ 1.8819658 2.7021059 4.3573785 ] [ 2.0173293 0.3147546 4.2768713 ] [ 3.6874299 0.3635867 2.5826629 ] [ 5.0270928 2.0991129 1.673465 ] [ 4.2317714 1.4824327 4.7634512 ] [ 4.4414108 3.5995426 3.4403251 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.568006e-10 2.4972741e-10 2.0021981e-10 ] [ 1.8819658e-10 2.7021059e-10 4.3573785e-10 ] [ 2.0173293e-10 3.147546e-11 4.2768713e-10 ] [ 3.6874299e-10 3.635867e-11 2.5826629e-10 ] [ 5.0270928e-10 2.0991129e-10 1.673465e-10 ] [ 4.231771400000001e-10 1.4824327e-10 4.763451200000001e-10 ] [ 4.4414108e-10 3.5995426e-10 3.4403251e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.15e-05 3.13e-05 3.9e-05 ] [ 5.57e-05 -6.45e-05 -2.95e-05 ] [ 3.07e-05 3.42e-05 -1.23e-05 ] [ -9.1e-06 3.21e-05 9.2e-06 ] [ -4.71e-05 -3e-06 4.54e-05 ] [ -3.96e-05 4.77e-05 -1.88e-05 ] [ -3.2e-05 -7.77e-05 -3.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.649033031099999e-14 5.014812864419999e-14 6.248488872599999e-14 ] [ 8.924123851379999e-14 -1.03340392893e-13 -4.726421070299999e-14 ] [ 4.91868226638e-14 5.479444088279999e-14 -1.97067725982e-14 ] [ -1.45798073694e-14 5.14298699514e-14 1.47400250328e-14 ] [ -7.546251946139999e-14 -4.806529901999999e-15 7.273881918359998e-14 ] [ -6.34461947064e-14 7.64238254418e-14 -3.012092071919999e-14 ] [ -5.126965228799999e-14 -1.244891244618e-13 -5.303204658539999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.14226006491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.906710516396036e-18 } }