{ "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" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.2934348 -0.5011883 -4.4923341 ] [ -5.8965507 2.0265823 6.8346089 ] [ -0.6485936 -14.1031639 -3.6960068 ] [ 11.3477281 3.8935184 17.7675038 ] [ -1.2307746 6.7744899 -1.9795627 ] [ 9.1067908 -0.3681029 -16.2563376 ] [ -0.3851651 2.2778644 1.8221285 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.969625398816246e-08 -8.029921834941823e-10 -7.197512727141419e-09 ] [ -9.447315752736342e-09 3.246942807937978e-09 1.095025068210844e-08 ] [ -1.039161510881942e-09 -2.259575966605231e-08 -5.921655734065111e-09 ] [ 1.818106481080521e-08 6.238104204529065e-09 2.846667943286621e-08 ] [ -1.971918305840696e-09 1.0853929425049e-08 -3.171609103477952e-09 ] [ 1.459068743048617e-08 -5.897658652876385e-10 -2.604552425713563e-08 ] [ -6.171025234522734e-10 3.649541117100429e-09 2.919371706845469e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.815669 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.533949532287814e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9390968 2.7429676 1.2256579 ] [ 2.2517151 2.7852999 3.8403688 ] [ 3.5914247 0.9332436 2.3837876 ] [ 5.0095096 2.9511165 3.5079803 ] [ 3.1899147 5.0283106 1.0957796 ] [ 4.6968899 2.9088236 0.8932777 ] [ 3.4892163 5.0688192 3.5988071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9390968e-10 2.7429676e-10 1.2256579e-10 ] [ 2.2517151e-10 2.7852999e-10 3.8403688e-10 ] [ 3.5914247e-10 9.332436e-11 2.3837876e-10 ] [ 5.0095096e-10 2.9511165e-10 3.5079803e-10 ] [ 3.1899147e-10 5.028310600000001e-10 1.0957796e-10 ] [ 4.6968899e-10 2.9088236e-10 8.932777e-11 ] [ 3.4892163e-10 5.0688192e-10 3.5988071e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.9e-06 4.3e-06 2.65e-05 ] [ -5.3e-06 8.6e-06 -9.2e-06 ] [ 1.64e-05 2.43e-05 -1.3e-06 ] [ -6.1e-06 -1.4e-06 -1.8e-06 ] [ 1.45e-05 2.3e-06 6.6e-06 ] [ 8.9e-06 -2.61e-05 -2.72e-05 ] [ -2.26e-05 -1.21e-05 6.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.452842140600001e-15 6.8893595262e-15 4.2457680801e-14 ] [ -8.4915361602e-15 1.37787190524e-14 -1.47400250328e-14 ] [ 2.62756967976e-14 3.893289220619999e-14 -2.0828296242e-15 ] [ -9.773277467399999e-15 -2.2430472876e-15 -2.8839179412e-15 ] [ 2.3231561193e-14 3.685006258199999e-15 1.05743657844e-14 ] [ 1.42593720426e-14 -4.18168101474e-14 -4.35792044448e-14 ] [ -3.62091919284e-14 -1.93863372714e-14 1.0414148121e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.010874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.846966128471812e-18 } }