[Pw_forum] inconsistent bands and DOS...

[Gokhan GOKOGLU]

Dear Paolo,
Did you get the metallic structure for both up and down spin states? Spin-up 
bands and dos are both metallic, this is evident. But the problem is down-spin states. Did you see
the metallic character for down spins at bands and DOS? Thank you very much for your effort. 
 
Dr. Gokhan Gokoglu
Dept. Physics
Karabuk Univ, TR 

----- Orjinal Mesaj -----
Kimden: Paolo Giannozzi <giannozz at democritos.it>
Tarih: Thursday, July 23, 2009 7:00 pm
Konu: Re: [Pw_forum] inconsistent bands and DOS...
Kime: PWSCF Forum <pw_forum at pwscf.org>

> Gokhan GOKOGLU wrote:
> 
> > There is a small gap in DOS, but the band structure seems to 
> be metallic.
> 
> I repeated your calculations at ecutwfc=35 Ry, which should be
> sufficient, and both bands and the dos are metallic
> 
> Paolo
> -- 
> Paolo Giannozzi, Democritos and University of Udine, Italy
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