Dear Tone Thanks you so much for the answer.
> > edir = 3 > > emaxpos = 0.9 > > eopreg = 0.2 > > eamp = 0.019447 > > / > > This input explains why you face SCF problems: they are inevitable with > your dipole-layer specification. You have placed your dipole layer > from 0.9 to 0.9+0.2=1.1. Note that position of emaxpos/eopreg is in > internal units, in range [0,1]. > Now I'm a little bit confused, because i use a previous thread about that http://www.democritos.it/pipermail/pw_forum/2009-December/015430.html What I have to do?
