{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9188502 -1.4685644 -4.0774701 ] [ -2.6138913 1.8629595 0.3977084 ] [ 2.765276 -0.0046672 -1.5398693 ] [ -1.5105546 -2.2751922 1.4183314 ] [ 3.1745935 -3.5283948 0.5475772 ] [ -0.8277939 4.1976146 3.1059201 ] [ 0.9312204 1.2162445 0.1478024 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.074336954586227e-09 -2.352899567204229e-09 -6.532827320053643e-09 ] [ -4.187915564675884e-09 2.984790180988323e-09 6.371991056255255e-10 ] [ 4.430460593760984e-09 -7.4776787862048e-12 -2.467142611873936e-09 ] [ -2.420175284501216e-09 -3.645259780699055e-09 2.272417428348508e-09 ] [ 5.086259528148278e-09 -5.653111704087103e-09 8.773153951511446e-10 ] [ -1.326272044347732e-09 6.725320030657256e-09 4.976232611290942e-09 ] [ 1.491979565984133e-09 1.948638519131013e-09 2.368055517291216e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.522996 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.846187494487546e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4745931 2.3995362 0.5254776 ] [ 2.211636 4.6424531 1.7373057 ] [ 4.7584712 2.2157122 1.4575866 ] [ 4.3640069 1.0727823 3.5218928 ] [ 6.612564 0.4245442 4.2203449 ] [ 4.0842689 3.2229551 4.7571117 ] [ 4.5250439 4.3799209 2.5941732 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4745931e-10 2.3995362e-10 5.254776e-11 ] [ 2.211636e-10 4.6424531e-10 1.7373057e-10 ] [ 4.7584712e-10 2.2157122e-10 1.4575866e-10 ] [ 4.3640069e-10 1.0727823e-10 3.5218928e-10 ] [ 6.612564e-10 4.245442e-11 4.2203449e-10 ] [ 4.0842689e-10 3.2229551e-10 4.7571117e-10 ] [ 4.5250439e-10 4.3799209e-10 2.5941732e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.9e-06 -6.4e-06 2.9e-06 ] [ -1.36e-05 5.2e-06 6.9e-06 ] [ -9.9e-06 2.8e-06 -1.06e-05 ] [ -3.05e-05 5.05e-05 -4.92e-05 ] [ 4.3e-05 -1.8e-05 4.16e-05 ] [ -3.7e-06 -9.8e-06 1.3e-05 ] [ 1.84e-05 -2.43e-05 -4.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.248488872599999e-15 -1.02539304576e-14 4.6463122386e-15 ] [ -2.17896022224e-14 8.331318496799998e-15 1.10550187746e-14 ] [ -1.58615486766e-14 4.486094575199999e-15 -1.69830723204e-14 ] [ -4.886638733699999e-14 8.090992001699999e-14 -7.882709039280001e-14 ] [ 6.889359526199999e-14 -2.8839179412e-14 6.665054797439999e-14 ] [ -5.9280535458e-15 -1.57013310132e-14 2.082829624199999e-14 ] [ 2.94800500656e-14 -3.893289220619999e-14 -7.530230179799999e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.011563 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.885770538041894e-18 } }