The ABINIT Users Mailing List ( CLOSED )

[Yong Liu <occupierliu@yahoo.com.cn>]

Dear Shaltaf:

       Thank you so much! I will try ppmodel 2.

shaltaf@pcpm.ucl.ac.be 写道：

> Dear Yong Liu,
>
> In such case one shall think to go beyond PPM approximation -to be implemnted
> soon in ABINIT- or may be to choose another PPM, so why dont you try with PPM of
> Hybertsen and Louie (ppmodel 2). The later PPM does not depond on (ppmfreq
> parameter), it uses only the dielectric matrix calculated on zero frequency and
> proceed toward the dynamical dependence by employing 'f sum rules'.
>
> -- 
> Riad Shaltaf UCL/SE/FSA/MAPR/PCPM
> Tel: +32 (0)10 47 81 91 B�timent Boltzmann, a+1
> Fax: +32 (0)10 47 34 52 1 place Croix du Sud
> Mel: shaltaf@pcpm.ucl.ac.be 1348 Louvain-la-Neuve (Belgique) 
>
> -------------------------------------------------
> This mail sent through IMP:
>  atlas.pcpm.ucl.ac.be

Sincerely.
Yong Liu

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Yong Liu,
Institute of Inorganic Materials,
Department of Materials Science and Engineering,
Zhejiang University,PR China
Doctoral student

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