[Wien] K-points for Band structure

[Paresh Chandra Rout]

Thanks Alpa . I will follow your suggestion and reply back to you  If any
problem occurs .

On Mon, Jul 20, 2015 at 11:10 AM, Alpa Dashora <dashoralpa at gmail.com> wrote:

> Dear Paresh,
>
> Save the xcrysden kpoint file as xcrysden.klist. Then in w2web, task
> section, select band structure window. In the symmetry pop-up, select "from
> xcrysden" after that follow the standard procedure as given in UG.
>
> Best regards,
>
> On Mon, Jul 20, 2015 at 10:57 AM, Paresh Chandra Rout <
> pareshchandra at iiserb.ac.in> wrote:
>
>> Dear all,
>> I want to plot band structure for my system through some high symmetry
>> kpoint path . I have generated the k-point mesh by taking the necessary
>> symmetry points by using xcrysden . But I do not how to use these generayed
>> points in wien2k for band structure calculation and the way to indicate
>> high symmetry symmetry points along with the bands. Any help would be
>> highly appreciated .
>>
>>
>>
>> Kind Regards
>> Paresh Chandra Rout
>> Research Scholar
>> Indian Institute of Science Education and Research Bhopal
>>
>>
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>>
>
>
> --
> Alpa Dashora
>
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