[xcrysden] Isosurface plotting at particluar k point

[Tone Kokalj]

On Thu, 2014-04-17 at 02:12 +0530, deepika goyal wrote:
> Dear XCrSDen Users,
> 
>                                 I need your help for drawing spatial
> charge distribution at one particular k-point from the output file
> ( CHGCAR) of band structure calculation of VASP software. 
> 
> I have converted CHGCAR to CHGCAR.xsf.gz file. 
> 
> My CHGCAR file include information of charge density from gamma to X
> path, and I need information of spacial charge distribution at gamma
> point only.

I frankly do not understand what is the problem, but it seems like a
VASP issue. You need to consult its User Guide as to determine how to
calculate charge density at a particular k-point.

Regards,
-- 
Anton Kokalj
J. Stefan Institute, Jamova 39, 1000 Ljubljana, Slovenia 
(tel: +386-1-477-3523 // fax:+386-1-477-3822)

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