Dear all QE users,
what i would like to know is this: if i want to calculate for instance the DOS
of a orthorhombic zirconia, and i want to implement an hybrid functional in
scf, e.g. B3LYP, do i have to preprocess ?something?, as in EXX_example, or
just i force the scf with the hybrid functional and then i directly run the
dos.x code? Can anyone help me? And so, can someone briefly explain to me the
aim of the preprocessing used in EXX_example? When it is necessary?
Thanks in advance,
Tommaso Francese
Universit? C? Foscari di Venezia