{ "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" [ [ 0.2609343 1.090408 2.782185 ] [ 0.9561081 2.831858 1.606096 ] [ 1.573969 0.2926919 1.087299 ] [ 2.9831 1.515461 0.0011433 ] [ 2.828068 2.074027 2.745594 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.609343e-11 1.090408e-10 2.782185e-10 ] [ 9.561081000000001e-11 2.831858e-10 1.606096e-10 ] [ 1.573969e-10 2.926919e-11 1.087299e-10 ] [ 2.9831e-10 1.515461e-10 1.1433e-13 ] [ 2.828068e-10 2.074027e-10 2.745594e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2209653 -0.4403029 0.8582885 ] [ 0.6280966 0.5413833 -0.9371349 ] [ -0.7846599 -1.1352053 0.5149362 ] [ 0.586363 1.4385946 0.4063449 ] [ -0.2088343 -0.4044697 -0.8424346 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.540254405848002e-10 -7.054430182624386e-10 1.375129779930909e-09 ] [ 1.006321696414844e-09 8.673916732978121e-10 -1.501455639685926e-09 ] [ -1.257163757416776e-09 -1.81879940645296e-09 8.250187476407506e-10 ] [ 9.394570976421418e-10 2.304882653918576e-09 6.510363041250665e-10 ] [ -3.345894358377461e-10 -6.480319025009898e-10 -1.349729031793136e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.072901 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.934291988679523e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3393077 1.224464 2.6311284 ] [ 1.1366274 3.1830082 1.4957921 ] [ 1.8235261 -0.1366867 1.3253809 ] [ 2.6208155 1.8218545 0.1900157 ] [ 2.6819026 1.7118059 2.5800001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.393077e-11 1.224464e-10 2.6311284e-10 ] [ 1.1366274e-10 3.1830082e-10 1.4957921e-10 ] [ 1.8235261e-10 -1.366867e-11 1.3253809e-10 ] [ 2.6208155e-10 1.8218545e-10 1.900157e-11 ] [ 2.6819026e-10 1.7118059e-10 2.5800001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.44e-05 -2.4e-06 3.7e-06 ] [ -8.9e-06 -1.88e-05 -1.54e-05 ] [ -2.27e-05 1.43e-05 -1.48e-05 ] [ 5e-06 -9e-07 1.36e-05 ] [ 1.22e-05 7.8e-06 1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.30713435296e-14 -3.845223921599999e-15 5.9280535458e-15 ] [ -1.42593720426e-14 -3.012092071919999e-14 -2.46735201636e-14 ] [ -3.636940959179999e-14 2.29111258662e-14 -2.37122141832e-14 ] [ 8.010883169999999e-15 -1.4419589706e-15 2.17896022224e-14 ] [ 1.95465549348e-14 1.24969777452e-14 2.06680785786e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }