{ "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" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0996557 0.5094539 0.3679206 ] [ 0.175417 0.3817114 -0.9283922 ] [ -0.1198949 -0.5480007 0.3239096 ] [ 3.3569308 -8.2821111 -14.0115472 ] [ 0.3733671 -2.2274114 22.5520551 ] [ -3.6861643 10.1663579 -8.3039458 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.596660339849138e-10 8.162351346801725e-10 5.894737884872602e-10 ] [ 2.810490186063779e-10 6.115690860114275e-10 -1.487448290027855e-09 ] [ -1.920928073157666e-10 -8.779939169556437e-10 5.189603926482864e-10 ] [ 5.378396089714926e-09 -1.326940488461203e-08 -2.244897353002813e-08 ] [ 5.982000435243414e-10 -3.568706499385227e-09 3.613237572990053e-08 ] [ -5.905886310544966e-09 1.628830108026131e-08 -1.330438793076244e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.4123577 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.069376407789981e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.6688146 1.9788963 2.1164047 ] [ 0.0088515 2.1350782 -0.0763121 ] [ 0.8720266 1.5445368 3.7683062 ] [ 3.768194 1.4225424 1.0347657 ] [ 3.0905319 1.2663597 3.2274834 ] [ 2.2273559 1.8569044 -0.6171316 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.688146000000001e-11 1.9788963e-10 2.1164047e-10 ] [ 8.8515e-13 2.1350782e-10 -7.63121e-12 ] [ 8.720266e-11 1.5445368e-10 3.7683062e-10 ] [ 3.768194e-10 1.4225424e-10 1.0347657e-10 ] [ 3.0905319e-10 1.2663597e-10 3.2274834e-10 ] [ 2.2273559e-10 1.8569044e-10 -6.171316e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.27e-05 -3.7e-06 1.26e-05 ] [ -8.7e-06 2.4e-06 -1e-06 ] [ 4.7e-06 1.7e-06 -2.16e-05 ] [ 2.33e-05 -5.2e-06 2.06e-05 ] [ -1.42e-05 1e-06 8.9e-06 ] [ -1.78e-05 3.8e-06 -1.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.03476432518e-14 -5.9280535458e-15 2.01874255884e-14 ] [ -1.39389367158e-14 3.845223921599999e-15 -1.602176634e-15 ] [ 7.530230179799999e-15 2.7237002778e-15 -3.46070152944e-14 ] [ 3.733071557219999e-14 -8.331318496799998e-15 3.300483866039999e-14 ] [ -2.27509082028e-14 1.602176634e-15 1.42593720426e-14 ] [ -2.851874408519999e-14 6.088271209199999e-15 -3.10822266996e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.79152 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.530080435934368e-18 } }