{ "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" [ [ 3.034718 3.53714 2.04977 ] [ 2.090115 3.249613 4.258758 ] [ 4.260617 1.92046 3.281861 ] [ 5.152468 4.155846 3.194292 ] [ 3.505339 5.178097 3.977293 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.034718e-10 3.53714e-10 2.04977e-10 ] [ 2.090115e-10 3.249613e-10 4.258758e-10 ] [ 4.260617e-10 1.92046e-10 3.281861e-10 ] [ 5.152468e-10 4.155846e-10 3.194292e-10 ] [ 3.505339e-10 5.178097e-10 3.977293e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6327447 -0.3253247 -0.6017174 ] [ 0.6112032 -0.2781269 -0.3454329 ] [ -0.4729471 0.0388085 0.3352289 ] [ 2.5644126 -1.0911105 -0.7969076 ] [ -2.069924 1.6557536 1.4088291 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.01376877362734e-09 -5.212276328030598e-10 -9.640575585512314e-10 ] [ 9.792554856660287e-10 -4.456084204668546e-10 -5.534445209948585e-10 ] [ -7.577447927380613e-10 6.217807190058899e-11 5.370959106215225e-10 ] [ 4.108641947655188e-09 -1.748151748212057e-09 -1.276786736177018e-09 ] [ -3.316383866955815e-09 2.652809729581382e-09 2.257193065319249e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.101859432689674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.778713977700789e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9328222 3.6967038 1.7048837 ] [ 2.1944129 3.1748593 3.9092611 ] [ 4.3107929 2.0810827 3.9471077 ] [ 5.0228904 4.0416012 2.7955287 ] [ 3.5823387 5.0469089 4.4051929 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9328222e-10 3.6967038e-10 1.7048837e-10 ] [ 2.1944129e-10 3.1748593e-10 3.9092611e-10 ] [ 4.3107929e-10 2.0810827e-10 3.9471077e-10 ] [ 5.0228904e-10 4.0416012e-10 2.7955287e-10 ] [ 3.5823387e-10 5.0469089e-10 4.4051929e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.4e-06 -4.8e-06 -4.7e-06 ] [ 1.01e-05 1.53e-05 -2.2e-06 ] [ 2.3e-06 1.27e-05 -5e-07 ] [ -8.8e-06 -1.5e-06 9.9e-06 ] [ 8e-07 -2.17e-05 -2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.0495771896e-15 -7.690447843199998e-15 -7.530230179799999e-15 ] [ 1.61819840034e-14 2.45133025002e-14 -3.5247885948e-15 ] [ 3.685006258199999e-15 2.03476432518e-14 -8.010883169999999e-16 ] [ -1.40991543792e-14 -2.403264951e-15 1.58615486766e-14 ] [ 1.2817413072e-15 -3.476723295779999e-14 -4.005441585e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }