{ "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" [ [ 1.517632 2.497403 2.430037 ] [ 2.356059 3.814055 4.10925 ] [ 3.523853 1.378281 0.7370457 ] [ 5.112372 2.112569 2.363129 ] [ 3.211069 1.305526 3.310768 ] [ 3.335071 3.69898 1.575396 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.517632e-10 2.497403e-10 2.430037e-10 ] [ 2.356059e-10 3.814055e-10 4.109250000000001e-10 ] [ 3.523853e-10 1.378281e-10 7.370457e-11 ] [ 5.112372e-10 2.112569e-10 2.363129e-10 ] [ 3.211069e-10 1.305526e-10 3.310768e-10 ] [ 3.335071e-10 3.69898e-10 1.575396e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.986991 1.1143387 -0.9056521 ] [ -0.6587662 3.639988 4.9301134 ] [ 0.447552 -4.1874342 -8.1005121 ] [ 6.366479 1.8719295 1.1398922 ] [ -1.2763053 -7.1378106 6.6314781 ] [ 0.1080315 4.6989887 -3.6953196 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.990040454168293e-09 1.785367427501936e-09 -1.451014633153031e-09 ] [ -1.055459812908971e-09 5.831903721640391e-09 7.898912492450295e-09 ] [ 7.17057356899968e-10 -6.709009231652483e-09 -1.297845121005427e-08 ] [ 1.020022389465169e-08 2.999161705395303e-09 1.826308648118855e-09 ] [ -2.04486652951036e-09 -1.143603336123752e-08 1.062479926070271e-08 ] [ 1.73085545035971e-10 7.528609898570035e-09 -5.920554718282226e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.436302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.672079920976747e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9045157 2.4838391 2.8589272 ] [ 1.4564747 4.4329053 4.1721797 ] [ 3.2442667 1.9428497 -0.6782605 ] [ 5.3537825 1.76048 2.5889025 ] [ 3.4141648 1.0680633 4.2251537 ] [ 3.6828516 3.1186766 1.3587232 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9045157e-10 2.4838391e-10 2.8589272e-10 ] [ 1.4564747e-10 4.4329053e-10 4.1721797e-10 ] [ 3.2442667e-10 1.9428497e-10 -6.782605000000001e-11 ] [ 5.3537825e-10 1.76048e-10 2.5889025e-10 ] [ 3.4141648e-10 1.0680633e-10 4.2251537e-10 ] [ 3.6828516e-10 3.1186766e-10 1.3587232e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.65e-05 1.89e-05 4.43e-05 ] [ -4.3e-06 2.5e-06 -1.88e-05 ] [ 1.52e-05 6.5e-06 -1.18e-05 ] [ 2.33e-05 7.7e-06 -2.07e-05 ] [ -1.09e-05 -2.54e-05 1.47e-05 ] [ -6.8e-06 -1.03e-05 -7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.6435914461e-14 3.02811383826e-14 7.09764248862e-14 ] [ -6.8893595262e-15 4.005441585e-15 -3.012092071919999e-14 ] [ 2.43530848368e-14 1.0414148121e-14 -1.89056842812e-14 ] [ 3.733071557219999e-14 1.23367600818e-14 -3.316505632379999e-14 ] [ -1.74637253106e-14 -4.06952865036e-14 2.35519965198e-14 ] [ -1.08948011112e-14 -1.65024193302e-14 -1.23367600818e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.12112 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.743105841191008e-18 } }