{ "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" [ [ 2.279778 0.7751999 2.437046 ] [ 2.78251 2.893695 2.394675 ] [ 4.420807 1.465039 1.355448 ] [ 4.595919 1.28038 3.495826 ] [ 3.524345 3.582501 0.1223867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.279778e-10 7.751999000000001e-11 2.437046e-10 ] [ 2.78251e-10 2.893695e-10 2.394675e-10 ] [ 4.420807e-10 1.465039e-10 1.355448e-10 ] [ 4.595919e-10 1.28038e-10 3.495826e-10 ] [ 3.524345e-10 3.582501e-10 1.223867e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3279079 -0.5916598 0.1143492 ] [ 0.2496221 1.1078495 -1.1380484 ] [ 0.3005624 -0.0084043 -1.0271805 ] [ 0.1607116 -0.153789 0.8771024 ] [ -0.3829881 -0.3539963 1.1737772 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.253663711556242e-10 -9.479434990272038e-10 1.832076148471834e-10 ] [ 3.999386926549997e-10 1.77497056826497e-09 -1.823354539818846e-09 ] [ 4.81554050371538e-10 -1.346517297418944e-11 -1.645724582441654e-09 ] [ 2.574883682113613e-10 -2.463971403362113e-10 1.40527295932757e-09 ] [ -6.136145798646125e-10 -5.671645957097031e-10 1.880598387868086e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7378526 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.193053289316495e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1085411 0.7914308 2.8679024 ] [ 2.6900592 2.6670347 1.8758004 ] [ 4.6763403 1.2782147 1.2704781 ] [ 4.6068097 1.2722721 3.4673207 ] [ 3.5216086 3.9878625 0.3238801 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1085411e-10 7.914308e-11 2.8679024e-10 ] [ 2.6900592e-10 2.6670347e-10 1.8758004e-10 ] [ 4.6763403e-10 1.2782147e-10 1.2704781e-10 ] [ 4.6068097e-10 1.2722721e-10 3.4673207e-10 ] [ 3.5216086e-10 3.9878625e-10 3.238801e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0278361 -0.0417702 0.0521181 ] [ 0.014012 0.1109293 -0.1146972 ] [ 0.0540903 -0.0381033 -0.004878 ] [ 0.0004123 1.3e-06 -0.0116747 ] [ -0.0406786 -0.0310571 0.0791318 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.459834863425088e-11 -6.692323788614016e-11 8.350240134051648e-11 ] [ 2.24496988106496e-11 1.777283310217094e-10 -1.837651723112218e-10 ] [ 8.666221407205825e-11 -6.104821643532864e-11 -7.815417556262401e-12 ] [ 6.6057742075584e-13 2.08282960704e-15 -1.870493139485376e-11 ] [ -6.517430188687489e-11 -4.975895952984768e-11 1.267831199218214e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.5331918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.367168040276227e-18 } }