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

Pavel B. Sorokin pbsorokin at gmail.com
Sun Apr 29 13:36:51 CEST 2007


Anyway, read carefully the url
http://cms.mpi.univie.ac.at/vasp/vasp/node57.html
and keep in mind that in your case only one direction is periodical
thus only in this one you should input number of kpoints more than one

2007/4/29, Daya sagar <sagars_daya at yahoo.co.in>:
>
> 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
> for calculating the band structures. Can anyone help me with the KPOINTS
> file for GaN nanowire.
>
> Thank in advance
>
> Regards,
> Dayasagar.
>  ________________________________
>  Check out what you're missing if you're not on Yahoo! Messenger


-- 
Sincerely yours,
Pavel B Sorokin



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