[xcrysden] Re: how to choose special points
Tone Kokalj
xcrysden@democritos.it
Wed, 03 Aug 2005 17:48:27 +0200
On Thu, 2005-07-28 at 12:59 -0700, Sherif Yehia wrote:
> Dear Tone
>
>
> Thank you very much for your kind asistance
>
> could you please inform me how to choose the k-points
>
> manually in your XCrysden program.
In the Brilluin-zone window you simply click on them with mouse
(left-button). If you want a path going over, say 5 k-points, you select
5 kpoints. Click the OK button. Next window will appear, specify the
total number of kpoints. Click OK. Next window will appear, save the
klist file. That's all.
I don't really understand your where is the problem?
Regards, Tone