[Pw_forum] Compute Debye temperature

[Sanjeev Gupta]

Please do not mail again -again.
1. with PWSCF package, find utility QHA, read and install.
see this post:
http://www.democritos.it/pipermail/pw_forum/2011-October/022205.html.
I also suggest, please read this good article also,
http://arxiv.org/abs/1112.4977v1

Further, read solid state Physics, like : "Solid State Physics: Neil W.
Ashcroft, N. David
*Mermin*<http://www.google.com/url?url=http://www.amazon.com/Solid-State-Physics-Neil-Ashcroft/dp/0030839939&rct=j&sa=U&ei=UAHCUOSNN4fQygGplYDgCQ&ved=0CBQQFjAA&q=Ashroff+and+Mermin%22+&usg=AFQjCNEz27QoQu--Ekg2u8b7kxedW3_FuQ>
"

bests

sanjeev



On Fri, Dec 7, 2012 at 3:00 AM, Yue-Wen Fang <yuewen.fang at gmail.com> wrote:

> Dear all,
>
> when computing *superconductivity*, I am puzzled by following questions:
> *1. *How to compute the *Debye temperature* in PWSCF?
> *2. *Can  *lambda.x* or (and)  *debye.x* calculate the Debye temperature?
> *3. *What are the *differences between lambda.x and  debye.x*? What* theory
> (or formula) *are they depend on?
> Any comments and suggestions are welcome！
> Thank you!
>
>
>
> --
>
> ------------------------------------------------------------------------------------------------------------
> 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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-- 
Dept. of Physics
Michigan Technological University
1400 Townsend Drive
Houghton
MI 49931, USA
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