[Pw_forum] ELF

Paolo Giannozzi giannozz at nest.sns.it
Wed Apr 23 15:21:46 CEST 2008


ali kazempoor wrote:

> We are working on MnAs(Mn is a transition metal)
> nanowire and plot the electron localization function
> in pp part. But for larger value we have not isovalue
> around Mn.why?
> second question is what is the meaning of ELF? is its
> concept close to the wannier function?

if you do not know what ELF means, why are you complaining
that "for larger value" (of what?) "we have not isovalue
around Mn" ?

Paolo
-- 
Paolo Giannozzi, Democritos and University of Udine, Italy


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