--- impurity 0 with degeneracy 8 --- Tr(Sigma*G)/2= 43.3422459664 Phidc= 94.034624042 Eimp-TrlogGimp= -43.1277448827 Tr(Sigma*G)/2-Phidc= -50.6923780756 = 17.5633829876 sum_i Sigma_oo(i)*n(i)/2= 43.5833717208 *n/2= 44.2779119611 :EORB -29.8065711535