[Pw_forum] phonon bandstructure
Mansoureh Pashangpour
mansourehp at gmail.com
Sat May 18 05:36:59 CEST 2013
Dear Ali,
I've found the answer with your help.
Thanks alot,
Mansoureh Pashangpour
IAU,Tehran, IRAN.
On 5/17/13, Oleg Sergeev <seoman at yandex.ru> wrote:
> Dear Mansoureh,
>
> take a look at PHON program: http://www.homepages.ucl.ac.uk/~ucfbdxa/phon/ .
> It can do what you want and may be used with QE.
>
> Regards,
> Oleg.
>
> 16.05.2013, 20:23, "Mansoureh Pashangpour" <mansourehp at gmail.com>:
>> Dear Ali,
>> By this way I can obtain phonon dispersion plot (phonon DOS plot) not
>> phonon modes in a selected Kpoint path.
>> regards,
>> M. pashangpour
>> IAU, Tehran, IRAN.
>>
>> On 5/16/13, Ali Tavana <tavana.ali at gmail.com> wrote:
>>
>>> Dear Mrs. Pashangpour,
>>> I guess you want to calculate a phonon dispersion diagram.
>>> You can find some simple calculations in the examples of QE.
>>> Or see this
>>> http://people.sissa.it/~degironc/QE-Tutorial/tutorial_disp.htm.
>>>
>>> Good luck
>>> --
>>> A. Tavana,
>>> Uni. of Mohaghegh Ardabili
>>> Ardabil, Iran.
>>>
>>> On Thu, May 16, 2013 at 1:55 PM, Mansoureh Pashangpour
>>> <mansourehp at gmail.com
>>>> wrote:
>>>> Dear all
>>>> where can I find an example about phonon bandstructure calculation? (I
>>>> know about phonon dos calclation.)
>>>> Regards,
>>>> M. pashangpour
>>>> IAU, Tehran , IRAN.
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