[Pw_forum] Can anyone help me with bandstructure calculations of GaN

Axel Kohlmeyer akohlmey at cmm.chem.upenn.edu
Sun Apr 29 01:48:06 CEST 2007


On 4/28/07, Daya sagar <sagars_daya at yahoo.co.in> wrote:
>
> Hi all,
>
>   I am doing the band structure calculations of GaN nanowires. I am using
> VASP for the calculations. I have no idea  of the KPOINTS in brillouin zone

since you want to use VASP, how about asking in the corresponding
VASP forum or switching to quantum espresso?

cheers,
   axel.

> for calculating the band structures. Can anyone help me with the KPOINTS
> file for GaN nanowire.
>
> Thank in advance
>
> Regards,
> Dayasagar.
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-- 
=======================================================================
Axel Kohlmeyer   akohlmey at cmm.chem.upenn.edu   http://www.cmm.upenn.edu
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