{ "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" [ [ 0.8494568 1.09498 0.2360667 ] [ 0.557157 2.835915 1.114432 ] [ 0.135541 1.869398 2.917972 ] [ 1.620291 0.3348641 1.837353 ] [ 2.814436 1.836887 0.4161362 ] [ 2.451507 2.913738 2.050042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.494568e-11 1.09498e-10 2.360667e-11 ] [ 5.57157e-11 2.835915e-10 1.114432e-10 ] [ 1.35541e-11 1.869398e-10 2.917972e-10 ] [ 1.620291e-10 3.348641e-11 1.837353e-10 ] [ 2.814436e-10 1.836887e-10 4.161362e-11 ] [ 2.451507e-10 2.913738e-10 2.050042e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.1565541 -2.4744107 5.6355595 ] [ -8.7715717 2.6321094 -4.7571242 ] [ -2.9652598 0.1829211 5.5366897 ] [ -9.0423508 -12.0603046 -1.2706738 ] [ 9.1437647 8.0784361 -3.6542934 ] [ 8.4788635 3.6412487 -1.4901577 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.057357181310385e-09 -3.964442973797363e-09 9.029161676027338e-09 ] [ -1.405360710541091e-08 4.217104144067916e-09 -7.621753175481903e-09 ] [ -4.750869926158084e-09 2.930719098710188e-10 8.870754793964166e-09 ] [ -1.448744304883218e-08 -1.93227380698467e-08 -2.035843855023095e-09 ] [ 1.464992602843633e-08 1.294308145204673e-08 -5.854823451023743e-09 ] [ 1.358463687065446e-08 5.833923537658392e-09 -2.3874958282451e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7555367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.221386340896385e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1056022 0.8555375 0.1899167 ] [ 0.3610939 3.0864102 1.263995 ] [ -0.457496 1.711229 3.2948317 ] [ 1.3822414 0.4156713 2.0584526 ] [ 3.2987049 2.1090174 0.0096123 ] [ 2.7382424 2.7079167 1.7551936 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1056022e-10 8.555375e-11 1.899167e-11 ] [ 3.610939e-11 3.0864102e-10 1.263995e-10 ] [ -4.574960000000001e-11 1.711229e-10 3.2948317e-10 ] [ 1.3822414e-10 4.156713e-11 2.0584526e-10 ] [ 3.2987049e-10 2.1090174e-10 9.612300000000001e-13 ] [ 2.7382424e-10 2.7079167e-10 1.7551936e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.67e-05 7.8e-05 -2.83e-05 ] [ -6.03e-05 1.99e-05 -3.95e-05 ] [ -3.19e-05 2e-07 1.41e-05 ] [ 4.54e-05 -7.12e-05 8.04e-05 ] [ 4.8e-06 2.05e-05 4.67e-05 ] [ 5.86e-05 -4.74e-05 -7.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.675634956736e-14 1.249697764224e-13 -4.534159836864e-14 ] [ -9.661125023424001e-14 3.188331475392e-14 -6.32859765216e-14 ] [ -5.110943420352001e-14 3.2043532416e-16 2.259069035328e-14 ] [ 7.273881858432e-14 -1.1407497540096e-13 1.2881500031232e-13 ] [ 7.69044777984e-15 3.28446207264e-14 7.482164819136e-14 ] [ 9.388754997888e-14 -7.594317182591999e-14 -1.177599816288e-13 ] ] } "relaxed-potential-energy" { "source-value" -14.424942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.3111304828796e-18 } }