[Pw_forum] Model pseudopotential

[Paolo Giannozzi]

On Dec 6, 2010, at 6:34 , Mahmoud Payami wrote:

> Is it possible to do pwscf calculations with a simple model  
> pseudopotential
> (for example, Ashcroft empty-core) without doing much effort on pw  
> code?

if the model pseudopotential can be written as a "normal"
pseudopotential in separable form, you just have to fill
the pseudopotential file with what you want

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