{ "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" [ [ 0.0317926 0.0463887 1.270674 ] [ 0.0111454 2.887791 2.968384 ] [ 2.5478 0.1715431 0.0845133 ] [ 1.93577 0.0052704 2.481441 ] [ 2.875434 2.93696 0.1676441 ] [ 2.282488 2.689422 2.770272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.17926e-12 4.63887e-12 1.270674e-10 ] [ 1.11454e-12 2.887791e-10 2.968384e-10 ] [ 2.5478e-10 1.715431e-11 8.451330000000001e-12 ] [ 1.93577e-10 5.270399999999999e-13 2.481441e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.282488e-10 2.689422e-10 2.770272e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2127886 -0.1590317 -2.3439251 ] [ -0.6120332 0.4117306 0.291902 ] [ -1.4026103 7.0678967 1.0499785 ] [ 2.4899024 2.9633967 1.6350632 ] [ -0.9432793 -7.3184936 1.2453922 ] [ 0.2552318 -2.9654988 -1.8784107 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.409249229015724e-10 -2.547968738052977e-10 -3.755382027066113e-09 ] [ -9.805852922722487e-10 6.596651468228003e-10 4.676785638178679e-10 ] [ -2.24722944926773e-09 1.132401894426571e-08 1.682251018902369e-09 ] [ 3.989263446220521e-09 4.747884950012707e-09 2.619660054153269e-09 ] [ -1.511300053795876e-09 -1.172551944199854e-08 1.995338283005854e-09 ] [ 4.089264262137612e-10 -4.751252885515039e-09 -3.009545732595584e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.273368 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.806192679608331e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5647414 -1.1063229 0.6315645 ] [ 0.4604024 4.0381377 3.6349204 ] [ 2.4996145 0.3495398 0.04164 ] [ 1.6240773 0.1959896 2.4735884 ] [ 2.6661807 2.6998681 0.374208 ] [ 1.8694136 2.5601629 2.5870071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.647414e-11 -1.1063229e-10 6.315645e-11 ] [ 4.604024e-11 4.0381377e-10 3.6349204e-10 ] [ 2.4996145e-10 3.495398e-11 4.164e-12 ] [ 1.6240773e-10 1.959896e-11 2.4735884e-10 ] [ 2.6661807e-10 2.6998681e-10 3.74208e-11 ] [ 1.8694136e-10 2.5601629e-10 2.5870071e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.5e-06 -2.52e-05 -8.9e-06 ] [ 2.9e-06 -7.6e-06 2.35e-05 ] [ 4.11e-05 5.14e-05 8e-07 ] [ -4.12e-05 3.39e-05 1.6e-06 ] [ -3.99e-05 -7.13e-05 1.98e-05 ] [ 3.86e-05 1.89e-05 -3.68e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.403264951e-15 -4.037485117679999e-14 -1.42593720426e-14 ] [ 4.6463122386e-15 -1.21765424184e-14 3.765115089899999e-14 ] [ 6.58494596574e-14 8.23518789876e-14 1.2817413072e-15 ] [ -6.600967732079998e-14 5.431378789259999e-14 2.5634826144e-15 ] [ -6.392684769659999e-14 -1.142351940042e-13 3.17230973532e-14 ] [ 6.18440180724e-14 3.02811383826e-14 -5.896010013119999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.830263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.215852422067474e-18 } }