{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5743456 1.51104 -0.2923508 ] [ -0.820359 2.4527105 1.7497527 ] [ -7.3586513 -2.1877919 -1.4105515 ] [ 2.8571863 -3.8541224 -0.309438 ] [ -0.7020329 0.0401108 -0.4584731 ] [ 5.4166738 1.3954931 1.1680282 ] [ -0.9671624 0.6425599 -0.4469676 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.52237973416071e-09 2.42095298103936e-09 -4.683976206912071e-10 ] [ -1.314360021291606e-09 3.929675453066456e-09 2.803412891218412e-09 ] [ -1.178985917061372e-08 -3.505229062234464e-09 -2.25995265435365e-09 ] [ 4.577717128844913e-09 -6.174984853856001e-09 -4.957743332716919e-10 ] [ -1.124780708679258e-09 6.42645865310472e-11 -7.345548881375453e-10 ] [ 8.678468196359989e-09 2.235826437728225e-09 1.871387489893079e-09 ] [ -1.549564998563361e-09 1.029494457725377e-09 -7.161210448750583e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.945509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.035405183903671e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3779211 1.8469495 3.1878452 ] [ 2.9574271 5.8290406 2.5882274 ] [ 2.637991 3.6019542 1.5520279 ] [ 4.5782221 1.8846931 1.8183904 ] [ 5.6197698 3.0419367 3.8906186 ] [ 4.9459042 4.452663 2.0523214 ] [ 3.2560678 4.048254 4.2385421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3779211e-10 1.8469495e-10 3.1878452e-10 ] [ 2.9574271e-10 5.8290406e-10 2.5882274e-10 ] [ 2.637991e-10 3.6019542e-10 1.5520279e-10 ] [ 4.5782221e-10 1.8846931e-10 1.8183904e-10 ] [ 5.6197698e-10 3.0419367e-10 3.8906186e-10 ] [ 4.945904200000001e-10 4.452663000000001e-10 2.0523214e-10 ] [ 3.2560678e-10 4.048254e-10 4.2385421e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.79e-05 -3e-06 -1.15e-05 ] [ -1.46e-05 -1.68e-05 3.4e-05 ] [ 3.64e-05 6.4e-06 -3.9e-05 ] [ -2.8e-05 -9e-07 4.19e-05 ] [ 6.76e-05 2.89e-05 2.6e-06 ] [ -1.31e-05 9e-07 -1.51e-05 ] [ 9.7e-06 -1.55e-05 -1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.276602710859999e-14 -4.806529901999999e-15 -1.8425031291e-14 ] [ -2.33917788564e-14 -2.691656745119999e-14 5.447400555599999e-14 ] [ 5.831922947759999e-14 1.02539304576e-14 -6.248488872599999e-14 ] [ -4.486094575199999e-14 -1.4419589706e-15 6.713120096459999e-14 ] [ 1.083071404584e-13 4.63029047226e-14 4.165659248399999e-15 ] [ -2.09885139054e-14 1.4419589706e-15 -2.41928671734e-14 ] [ 1.55411133498e-14 -2.4833737827e-14 -2.09885139054e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.382118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.425792984503081e-18 } }