{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7940772 -0.5036938 -0.6114652 ] [ -2.9886649 -0.4658696 1.9903463 ] [ -0.9165031 -0.7874348 0.1983716 ] [ 0.1010438 0.7446159 -0.595229 ] [ 4.1066963 -2.590612 -2.3741806 ] [ 0.2400854 3.8748699 1.9414558 ] [ 0.2514198 -0.2718757 -0.549299 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.272251924950326e-09 -8.070064304019109e-10 -9.796752478727963e-10 ] [ -4.78836903018557e-09 -7.464053814614476e-10 3.188886309155783e-09 ] [ -1.468399839710725e-09 -1.261609626964324e-09 3.178263397506893e-10 ] [ 1.61890014036791e-10 1.193006186455951e-09 -9.536619878221633e-10 ] [ 6.579652800585863e-09 -4.15061797996393e-09 -3.803856650876917e-09 ] [ 3.846592148754163e-10 6.208225962421634e-09 3.110555093076561e-09 ] [ 4.028189255662119e-10 -4.355928903036345e-10 -8.800740156288191e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.238047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.242492575405158e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8691174 2.6276309 2.9210322 ] [ 2.5685261 0.8480574 5.4996559 ] [ 1.8964809 0.2719835 3.2701398 ] [ 3.7538255 1.0751447 1.9742363 ] [ 4.6431712 0.7808896 4.1314768 ] [ 3.6075624 2.9254602 4.6735756 ] [ 4.0884235 3.4342361 2.3954764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8691174e-10 2.6276309e-10 2.9210322e-10 ] [ 2.5685261e-10 8.480574e-11 5.4996559e-10 ] [ 1.8964809e-10 2.719835e-11 3.2701398e-10 ] [ 3.7538255e-10 1.0751447e-10 1.9742363e-10 ] [ 4.6431712e-10 7.808895999999999e-11 4.1314768e-10 ] [ 3.6075624e-10 2.9254602e-10 4.6735756e-10 ] [ 4.0884235e-10 3.4342361e-10 2.3954764e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0049447 0.1861698 0.0762437 ] [ 0.5516348 -0.1095028 -0.6846522 ] [ -0.2844968 0.251704 0.1497735 ] [ 0.1747768 0.129844 -0.0408143 ] [ -0.036145 0.0405279 0.6344447 ] [ -0.2671781 -0.2411416 0.4009562 ] [ -0.133647 -0.2576012 -0.5359517 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.92228273686976e-12 2.982769010590119e-10 1.22155873623289e-10 ] [ 8.838163797796839e-10 -1.754428260721382e-10 -1.096933748219286e-09 ] [ -4.558141216524134e-10 4.032742641618431e-10 2.399636001153888e-10 ] [ 2.800233028182375e-10 2.080330211511552e-10 -6.539171725431744e-11 ] [ -5.791067395881599e-11 6.493285387012032e-11 1.01649246553047e-09 ] [ -4.280665054097644e-10 -3.863514338223053e-10 6.42402649604809e-10 ] [ -2.141260988400576e-10 -4.127226201300249e-10 -8.586892836180154e-10 ] ] } "relaxed-potential-energy" { "source-value" -21.659215 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.470188789788067e-18 } }