{ "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" [ [ 2.476712 2.310837 1.57832 ] [ 2.970546 4.476183 1.171414 ] [ 2.629523 3.538885 3.808943 ] [ 5.406765 3.077785 1.539132 ] [ 4.254834 1.46676 3.134429 ] [ 4.456572 4.8029 2.877728 ] [ 4.871099 3.222036 4.56833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.476712e-10 2.310837e-10 1.57832e-10 ] [ 2.970546e-10 4.476183e-10 1.171414e-10 ] [ 2.629523e-10 3.538885e-10 3.808943e-10 ] [ 5.406765000000001e-10 3.077785e-10 1.539132e-10 ] [ 4.254834e-10 1.46676e-10 3.134429e-10 ] [ 4.456572000000001e-10 4.8029e-10 2.877728e-10 ] [ 4.871099000000001e-10 3.222036e-10 4.56833e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5136544 -0.7656954 -0.2806944 ] [ -0.6761817 0.508229 -0.9171942 ] [ -2.0210179 0.0243093 0.6446812 ] [ 0.50047 0.0801064 -0.2182191 ] [ 0.2864696 -0.688589 -0.0213932 ] [ 1.3134485 1.9280236 -0.8533388 ] [ 1.110466 -1.0863838 1.6461586 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.229650776312894e-10 -1.226779278641284e-09 -4.497220089746496e-10 ] [ -1.083362520078398e-09 8.14272628521186e-10 -1.469507116080323e-09 ] [ -3.238027656275748e-09 3.894779244889619e-11 1.032893155019081e-09 ] [ 8.018413400179799e-10 1.283446023138576e-10 -3.496255431125094e-10 ] [ 4.589748994713264e-10 -1.103241206229426e-09 -3.42756851664888e-11 ] [ 2.104376496662349e-09 3.089034361720562e-09 -1.367199486245599e-09 ] [ 1.779162678051444e-09 -1.740578739916129e-09 2.637436844778152e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.205315 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.955507050360971e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.913935 3.2169358 0.3162041 ] [ 2.8799473 4.3592307 0.6289149 ] [ 2.5488299 3.6848323 5.4737064 ] [ 6.7725126 4.2224648 1.4637763 ] [ 5.2333687 0.8523651 4.6749428 ] [ 4.5927512 3.7859029 2.0522509 ] [ 4.1247064 2.7736545 4.0685005 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.139350000000001e-11 3.2169358e-10 3.162041e-11 ] [ 2.8799473e-10 4.359230700000001e-10 6.289149000000001e-11 ] [ 2.5488299e-10 3.6848323e-10 5.4737064e-10 ] [ 6.7725126e-10 4.2224648e-10 1.4637763e-10 ] [ 5.2333687e-10 8.523651e-11 4.6749428e-10 ] [ 4.592751200000001e-10 3.7859029e-10 2.0522509e-10 ] [ 4.1247064e-10 2.7736545e-10 4.0685005e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.92e-05 3.49e-05 -1.44e-05 ] [ -1.43e-05 -2.03e-05 -2.85e-05 ] [ -1.53e-05 2.2e-06 7.43e-05 ] [ 8.6e-06 1.32e-05 -3.3e-06 ] [ 1.63e-05 2.04e-05 8e-07 ] [ -1.21e-05 -5.61e-05 2.27e-05 ] [ -2.4e-06 5.6e-06 -5.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.076179137279999e-14 5.59159645266e-14 -2.30713435296e-14 ] [ -2.29111258662e-14 -3.252418567019999e-14 -4.5662034069e-14 ] [ -2.45133025002e-14 3.5247885948e-15 1.190417239062e-13 ] [ 1.37787190524e-14 2.11487315688e-14 -5.2871828922e-15 ] [ 2.61154791342e-14 3.26844033336e-14 1.2817413072e-15 ] [ -1.93863372714e-14 -8.988210916739999e-14 3.636940959179999e-14 ] [ -3.845223921599999e-15 8.972189150399999e-15 -8.28325319778e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.820197 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.53467499786769e-18 } }