[Pw_forum] Re: Negative PDOS and Graphing of Energy Bands

John B Burdette burde1jb at cmich.edu
Thu May 25 16:14:01 CEST 2006


Hi Paolo,

Regarding the smearing, yes indeed I was using the Methfessel-
Paxton broadening.  When I used the simple Gaussian 
broadening, I received only positive weights.  Thank you very 
much Paolo and Andrea.

Also thank you for clearing up the independent variable 
question.  I believed they were the k-points, but I could not 
find this information in the code so I felt inclined to ask.

Thank you very much,

John



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