[Pw_forum] phonon calculation in finite temperature

Yue-Wen Fang yuewen.fang at gmail.com
Thu Mar 28 10:57:27 CET 2013


Dear Dr. Wang,

as far as i  know, phonon calculation in finite temperature has not been
implemented up till now.

Best!
Yuewen

2013/3/25 wangwei <wangweiphysics at yahoo.com.cn>

> Dear,
> Whether the phonon calculation can be run in finite temperature by pwscf
> program? And how to set the temperature?
>
> With best regards and thanks for any reply!
>
> W. Wang
> Huaibei Normal University
>
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> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>



-- 
------------------------------------------------------------------------------------------------------------
Yue-Wen FANG, PhD candidate
Key Laboratory of Polar Materials and Devices, Ministry of
Education<http://clpm.ecnu.edu.cn/>
East China Normal University <http://www.ecnu.edu.cn/english/>
Phone: +86-18321726131
I will persist until I succeed!
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