[Pw_forum] Regarding m-projected DOS

himanshu at iopb.res.in himanshu at iopb.res.in
Sat Nov 8 05:03:34 CET 2014


Respected QE users,
                    I want to plot DOS of different 4d orbitals of Pd atom.
I had run scf calculation with non orbit case. According to manual using
projwfc.x provides following data in fildos.

The format for the collinear, spin-unpolarized case and the
  non-collinear, spin-orbit case is:
      E DOS(E) PDOS(E)
      ...

                     So is there any possibility to get separate DOS for
individual d orbital of atom.

                    Thanking you.

Sincerely
Himanshu
IOP




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