triqs_dftkit.wien2k.driver.Driver.read_dft_energy

Driver.read_dft_energy()[source]

Total energy in eV, from the last :ENE line in case.scf.

After a charge update this already includes the interaction energy: lapw2 -qdmft folds correner into :SUM (ETOT = ETOT + correner) and subtracts the DFT in-window band energy itself. Callers must therefore not add Eint_m_dc again, and there is no separate band energy correction to compute.