{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9213704 2.20313 -0.3029042 ] [ -2.6896649 2.649211 1.235237 ] [ 0.1038415 -1.1886379 -0.9490465 ] [ 1.2400795 -2.871115 0.0059222 ] [ -0.5756263 -0.7925881 0.0107915 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.078374760139233e-09 3.52980340766442e-09 -4.853060315804627e-10 ] [ -4.309318256069946e-09 4.244503962735774e-09 1.979067858852257e-09 ] [ 1.66372424939511e-10 -1.904407869666828e-09 -1.520540126879481e-09 ] [ 1.986826399202403e-09 -4.60003336652691e-09 9.488410461874799e-12 ] [ -9.222550077758742e-10 -1.269866134206455e-09 1.7289889145811e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -19.496388 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.123665730099799e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6434717 1.9882636 2.2125919 ] [ 2.887833 4.1076975 1.1887549 ] [ 2.5834174 3.9468375 3.5178889 ] [ 4.1817822 2.282804 0.4546766 ] [ 4.6164917 3.2484955 2.5575031 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6434717e-10 1.9882636e-10 2.2125919e-10 ] [ 2.887833e-10 4.1076975e-10 1.1887549e-10 ] [ 2.5834174e-10 3.9468375e-10 3.5178889e-10 ] [ 4.1817822e-10 2.282804e-10 4.546766e-11 ] [ 4.6164917e-10 3.2484955e-10 2.5575031e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.7e-06 8.7e-06 -2e-06 ] [ 5.1e-06 2.3e-06 -1.1e-06 ] [ -4.2e-06 -5.3e-06 7.9e-06 ] [ -2.2e-06 -9.9e-06 -2.7e-06 ] [ -6.3e-06 4.1e-06 -2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.23367600818e-14 1.39389367158e-14 -3.204353268e-15 ] [ 8.1711008334e-15 3.685006258199999e-15 -1.7623942974e-15 ] [ -6.729141862799999e-15 -8.4915361602e-15 1.26571954086e-14 ] [ -3.5247885948e-15 -1.58615486766e-14 -4.3258769118e-15 ] [ -1.00937127942e-14 6.568924199399999e-15 -3.364570931399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245508681305e-18 } }