{ "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" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7735426 -0.7220728 -0.4015804 ] [ 0.7920625 0.9583394 0.4218609 ] [ 0.4738684 -0.1802618 -0.7049126 ] [ 0.0 0.0 0.0 ] [ 0.3514021 -1.375792 -0.1686027 ] [ 0.154653 0.2502053 0.468569 ] [ 0.0015566 1.0695818 0.3846658 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.841528513123609e-09 -1.156888168206955e-09 -6.434027335523735e-10 ] [ 1.269024030167625e-09 1.535428994121579e-09 6.758956767782105e-10 ] [ 7.592208780709656e-10 -2.888112439627811e-10 -1.129394496732188e-09 ] [ 0.0 0.0 0.0 ] [ 5.630082337585314e-10 -2.204261795644127e-09 -2.701313063693117e-10 ] [ 2.47781422978002e-10 4.008730853629602e-10 7.507303032167459e-10 ] [ 2.4939481484844e-12 1.713658968111661e-09 6.163025566589172e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.216732 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.636900928624009e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.5670946 0.2997489 1.5999718 ] [ 1.2982924 1.5235096 1.0609411 ] [ 2.5301505 2.8446993 2.4768628 ] [ 1.738494 0.324563 4.412062 ] [ 5.6197131 0.5981273 3.6048924 ] [ 3.7933682 2.9469788 6.2529379 ] [ 3.9810804 2.1299391 4.1115619 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.670946e-11 2.997489e-11 1.5999718e-10 ] [ 1.2982924e-10 1.5235096e-10 1.0609411e-10 ] [ 2.5301505e-10 2.8446993e-10 2.4768628e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 5.6197131e-10 5.981273000000001e-11 3.6048924e-10 ] [ 3.793368200000001e-10 2.9469788e-10 6.2529379e-10 ] [ 3.9810804e-10 2.1299391e-10 4.1115619e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.9e-06 -2.1e-06 1.3e-05 ] [ 8.6e-06 -8e-06 -2.85e-05 ] [ 7.8e-06 1.18e-05 2.13e-05 ] [ 0.0 0.0 0.0 ] [ -3.7e-06 4e-07 -1.52e-05 ] [ -9.1e-06 7.1e-06 -8.3e-06 ] [ 4.3e-06 -9.2e-06 1.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.26571954086e-14 -3.364570931399999e-15 2.082829624199999e-14 ] [ 1.37787190524e-14 -1.2817413072e-14 -4.5662034069e-14 ] [ 1.24969777452e-14 1.89056842812e-14 3.41263623042e-14 ] [ 0.0 0.0 0.0 ] [ -5.9280535458e-15 6.408706536e-16 -2.43530848368e-14 ] [ -1.45798073694e-14 1.13754541014e-14 -1.32980660622e-14 ] [ 6.8893595262e-15 -1.47400250328e-14 2.83585264218e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.241847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.1215777854403e-18 } }