--- impurity 0 with degeneracy 8 --- Tr(Sigma*G)/2= 43.1571829853 Phidc= 93.8478375771 Eimp-TrlogGimp= -42.9719993226 Tr(Sigma*G)/2-Phidc= -50.6906545919 = 17.5268339787 sum_i Sigma_oo(i)*n(i)/2= 43.4409849581 *n/2= 44.0980018358 :EORB -29.8055577638