[Pw_forum] About Pseudo-Potential generation

[Paolo Giannozzi]

On Jan 25, 2007, at 13:44 , Lawrence Lee wrote:

> In my example, some may use [Ne]3s1.5 for Mg. And you said that  
> this is
> for computational convenience. Can you elaborate more on this point?

see atomic_doc/pseudo-gen.tex

> By the way, if this config is used, should I correspondingly set  
> zval=1.5

no, you shouldn't
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Paolo Giannozzi, Democritos and University of Udine, Italy