{ "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" [ [ 0.8403174 0.0019487 1.613535 ] [ 0.0637823 2.769237 1.974876 ] [ 2.710551 0.627508 0.2521163 ] [ 2.357874 0.9595638 1.99039 ] [ 1.619464 1.82467 0.5389468 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.403174e-11 1.9487e-13 1.613535e-10 ] [ 6.37823e-12 2.769237e-10 1.974876e-10 ] [ 2.710551e-10 6.27508e-11 2.521163e-11 ] [ 2.357874e-10 9.595638e-11 1.99039e-10 ] [ 1.619464e-10 1.82467e-10 5.389467999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -24.3293863 -21.6560247 6.6634254 ] [ -4.9793674 4.9083871 2.4238248 ] [ 30.5420932 -22.5903233 -28.5268234 ] [ 19.9559286 1.6592302 36.5625244 ] [ -21.189268 37.6787308 -17.1229512 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.897997392827181e-08 -3.469677647380734e-08 1.067598439032489e-08 ] [ -7.977826034653682e-09 7.864103057456311e-09 3.883395427475235e-09 ] [ 4.893382767533466e-08 -3.61936878475735e-08 -4.570500951717037e-08 ] [ 3.197292224927407e-08 2.658379834965308e-09 5.857962179110956e-08 ] [ -3.394894980146557e-08 6.036798158917687e-08 -2.74339920917393e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 22.535923 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.6106528958749e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5006994 0.4586653 2.8107069 ] [ -0.2527857 2.1614375 1.3740211 ] [ 3.242009 1.1457611 0.2623702 ] [ 2.660636 -0.1690029 2.1237248 ] [ 1.44143 2.5860664 -0.2009588 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.006994000000001e-11 4.586653e-11 2.8107069e-10 ] [ -2.527857e-11 2.1614375e-10 1.3740211e-10 ] [ 3.242009e-10 1.1457611e-10 2.623702e-11 ] [ 2.660636e-10 -1.690029e-11 2.1237248e-10 ] [ 1.44143e-10 2.5860664e-10 -2.009588e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.03e-05 -7.4e-06 2.01e-05 ] [ 5.7e-06 -2e-06 -4.8e-06 ] [ 1.9e-05 -4.6e-06 -4.1e-06 ] [ -9e-06 1.21e-05 -1.29e-05 ] [ -5.5e-06 1.9e-06 1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.650241919424e-14 -1.185610699392e-14 3.220375007808e-14 ] [ 9.13240673856e-15 -3.2043532416e-15 -7.69044777984e-15 ] [ 3.04413557952e-14 -7.370012455680001e-15 -6.568924145279999e-15 ] [ -1.44195895872e-14 1.938633711168e-14 -2.066807840832e-14 ] [ -8.8119714144e-15 3.04413557952e-15 2.56348259328e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.57084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853852933101747e-18 } }