[Pw_forum] The definition of rho0 in pp's generation？

[Yue-Wen Fang]

Dear Paolo,

Thank you for your help!

Yue-Wen FNAG

2013/3/16 Paolo Giannozzi <paolo.giannozzi at uniud.it>

> On Fri, 2013-03-15 at 20:14 +0800, Yue-Wen Fang wrote:
>
> > What's the definition of rho0 in pp's generation using ld1.x?
> > Input File Description of ld1.x tells us that rho0 is the charge at
> > the origin when using the Rabe-Rappe-Kaxiras-Joannopoulos method.
> > But i still cannot figure it out clearly, how to understand origin?
>
> r=0. The position of the nucleus in the atom.
>
> P.
>
> --
> Paolo Giannozzi, Dept. Chemistry&Physics&Environment,
> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
>
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-- 
------------------------------------------------------------------------------------------------------------
Yue-Wen FANG, PhD candidate
Key Laboratory of Polar Materials and Devices, Ministry of
Education<http://clpm.ecnu.edu.cn/>
East China Normal University <http://www.ecnu.edu.cn/english/>
Phone: +86-18321726131
I will persist until I succeed!
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