[Pw_forum] where does pp.x get degauss from for plot_num = 3?

[Paolo Giannozzi]

On Sep 16, 2010, at 22:22 , J. D. Burton wrote:

>  Where does the pp.x program get the value of degauss that it uses  
> to smear out the eigenvalues for the ldos calculation? I want to  
> try changing this to see what happens to the result.
>

the value of degauss (and of "ngauss", used to select the kind of  
smearing)
>

is read from the xml data file, if present. Rather than trying to  
locate where
it is read, take inspiration from PP/dos.f90 (search for  "gauss")

P.
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Paolo Giannozzi, Dept of Physics, University of Udine
via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222