{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5353879 0.9970923 2.660459 ] [ 0.8434423 2.30713 1.528251 ] [ 1.912844 1.041012 0.0827139 ] [ 2.263312 0.2132627 1.656325 ] [ 2.91731 1.870919 1.650254 ] [ 2.184429 2.813613 2.907386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.353879e-11 9.970923e-11 2.660459e-10 ] [ 8.434423e-11 2.30713e-10 1.528251e-10 ] [ 1.912844e-10 1.041012e-10 8.27139e-12 ] [ 2.263312e-10 2.132627e-11 1.656325e-10 ] [ 2.91731e-10 1.870919e-10 1.650254e-10 ] [ 2.184429e-10 2.813613e-10 2.907386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -62.090629 -34.5269208 50.1602635 ] [ -56.8265997 51.4954267 -20.446182 ] [ 2.1268099 -9.42475 -69.2672153 ] [ 22.1063649 -85.3560482 5.0674144 ] [ 84.2093211 23.5026029 -13.2847897 ] [ 10.4747328 54.3096894 47.7705092 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.94801541545665e-08 -5.531822529397323e-08 8.036560147286758e-08 ] [ -9.10462494789003e-08 8.25047687368601e-08 -3.275839478502179e-08 ] [ 3.407525098665986e-09 -1.51001141068848e-08 -1.109783129415801e-07 ] [ 3.541830101365373e-08 -1.367554648699179e-07 8.118892879585259e-09 ] [ 1.349182055198601e-07 3.765532089432628e-08 -2.128457946958464e-08 ] [ 1.678237200128692e-08 8.701371463958958e-08 7.653679300395131e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 87.302201 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.398735453865824e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.3672839 0.4227234 2.8381177 ] [ 0.3235253 2.5515791 1.5311797 ] [ 1.4178174 1.2591847 -0.3057353 ] [ 2.4281733 -0.1043847 1.5278081 ] [ 3.8027108 1.6196403 2.445835 ] [ 2.3172145 3.4942861 2.4481837 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.672839e-11 4.227234000000001e-11 2.838117700000001e-10 ] [ 3.235253e-11 2.5515791e-10 1.5311797e-10 ] [ 1.4178174e-10 1.2591847e-10 -3.057353e-11 ] [ 2.4281733e-10 -1.043847e-11 1.5278081e-10 ] [ 3.8027108e-10 1.6196403e-10 2.445835e-10 ] [ 2.3172145e-10 3.4942861e-10 2.4481837e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.66e-05 3.1e-05 -4.65e-05 ] [ 5.1e-05 -4.56e-05 3e-06 ] [ 1.7e-06 -1.44e-05 5.01e-05 ] [ -3.55e-05 5.56e-05 1.48e-05 ] [ 1.19e-05 -3.19e-05 -3.62e-05 ] [ -4.58e-05 5.4e-06 1.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.659613190528e-14 4.96674752448e-14 -7.45012128672e-14 ] [ 8.17110076608e-14 -7.305925390848e-14 4.8065298624e-15 ] [ 2.72370025536e-15 -2.307134333952e-14 8.026904870208e-14 ] [ -5.68772700384e-14 8.908102011648e-14 2.371221398784e-14 ] [ 1.906590178752e-14 -5.110943420352001e-14 -5.799879367296e-14 ] [ -7.337968923264e-14 8.65175375232e-15 2.371221398784e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.021911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.246557798313835e-18 } }