Hi All, could anyone tell me if QE writes out band energy, i.e. the sum of kohn-sham eigenvalues up to the fermi level, somewhere in one of its output files? I was trying to find it in stdout but it's not there. Or is there a way, perhaps by setting up a flag, to to tell pw.x to print this value? Thanks in advance!
Best, Ryky -------------------------------------------- Ryky Nelson Institut für Anorganische Chemie RWTH Aachen University
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