[Pw_forum] Which smearing scheme is best for the semiconductor DOS and PDOS calculations

wujianchun jcwu.suda at hotmail.com
Thu Sep 2 03:13:54 CEST 2010


Dear Dr. Paolo Giannozzi,

 

Thank you for your kind help.

 

Rgds

Jianchun 
 
> Date: Wed, 1 Sep 2010 12:21:40 +0200
> From: giannozz at democritos.it
> To: pw_forum at pwscf.org
> Subject: Re: [Pw_forum] Which smearing scheme is best for the semiconductor DOS and PDOS calculations
> 
> wujianchun wrote:
> 
> > For the DOS and PDOS, there are several smearing schemes:
> 
> if all you need is a plot, use simple gaussian
> 
> P.
> -- 
> Paolo Giannozzi, Democritos and University of Udine, Italy
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