{ "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" [ [ 0.2519361 0.630526 0.2961672 ] [ 1.040527 1.338339 0.9480581 ] [ 1.471162 2.964903 0.310665 ] [ 0.0960364 2.590998 1.829013 ] [ 2.039261 0.0625187 0.2196196 ] [ 2.19391 1.549757 2.906446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.519361e-11 6.30526e-11 2.961672e-11 ] [ 1.040527e-10 1.338339e-10 9.480581e-11 ] [ 1.471162e-10 2.964903e-10 3.10665e-11 ] [ 9.60364e-12 2.590998e-10 1.829013e-10 ] [ 2.039261e-10 6.25187e-12 2.196196e-11 ] [ 2.19391e-10 1.549757e-10 2.906446e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -107.0681301 -75.9965111 -75.4846076 ] [ 86.9706353 62.8539945 81.6874689 ] [ 8.6055453 20.4140499 -14.3337486 ] [ -16.2581116 14.2308106 16.6584501 ] [ 27.9027271 -21.3697741 -10.2166546 ] [ -0.1526661 -0.1325699 1.6890918 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.715420548789928e-07 -1.217598333467877e-07 -1.20939673526982e-07 ] [ 1.393423185737832e-07 1.007032005117918e-07 1.308777528839071e-07 ] [ 1.378760348889532e-08 3.270691348562457e-08 -2.296519689534473e-08 ] [ -2.604836630387728e-08 2.280027203835282e-08 2.668977928898342e-08 ] [ 4.470509701618258e-08 -3.423815245479736e-08 -1.636888514290877e-08 ] [ -2.445980562087149e-10 -2.124003944017939e-10 2.706223392344989e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 46.002815 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.370463468398756e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.006211 -0.4281819 0.5374955 ] [ 1.302056 1.4803141 1.3097913 ] [ 1.7144224 3.7066969 0.402284 ] [ -0.3574928 3.2645011 1.4237505 ] [ 2.0658732 0.0138811 -0.4836876 ] [ 2.3741847 1.0998304 3.3203351 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.211e-13 -4.281819e-11 5.374955e-11 ] [ 1.302056e-10 1.4803141e-10 1.3097913e-10 ] [ 1.7144224e-10 3.7066969e-10 4.02284e-11 ] [ -3.574928e-11 3.2645011e-10 1.4237505e-10 ] [ 2.0658732e-10 1.38811e-12 -4.836876e-11 ] [ 2.3741847e-10 1.0998304e-10 3.3203351e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.74e-05 -2.3e-05 -6e-07 ] [ -2.74e-05 -1.59e-05 -1.41e-05 ] [ 4.43e-05 -8.1e-06 1.42e-05 ] [ -1.6e-05 -1.28e-05 2.1e-06 ] [ 6.2e-06 2.14e-05 -2.33e-05 ] [ 2.03e-05 3.83e-05 2.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.389963940992e-14 -3.68500622784e-14 -9.6130597248e-16 ] [ -4.389963940992e-14 -2.547460827072e-14 -2.259069035328e-14 ] [ 7.097642430144e-14 -1.297763062848e-14 2.275090801536e-14 ] [ -2.56348259328e-14 -2.050786074624e-14 3.36457090368e-15 ] [ 9.93349504896e-15 3.428657968511999e-14 -3.733071526464e-14 ] [ 3.252418540224e-14 6.136336457664001e-14 3.508766799552e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.403987 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.307773121770713e-18 } }