[Pw_forum] Is it possible to calculate the phonon dos for each branch?

[Yamit]

Dear Prof. Eyvaz

Could you please upload/email the revised version of QHA?

Warm Regards
Amit
On Mon, 31 May 2010 21:38:12 +0530  wrote
>Hi Paolo, 



Sorry for the confusing note I have written. You are right, now QHA in QE v.4.2. 

In fact, I was talking about the possibility for branch-resolved phonon DOS, that is not included in the current version of QHA. But you know I am going top upgrade it (QHA), so i will include it, too. One reason for not including of this option was that I had no data (and do not have) to compare.



Bests,

Eyvaz.

 

--- On Mon, 5/31/10, Paolo Giannozzi  wrote:



> From: Paolo Giannozzi 

> Subject: Re: [Pw_forum] Is it possible to calculate the phonon dos for each branch?

> To: "PWSCF Forum" 

> Date: Monday, May 31, 2010, 6:26 PM

> Eyvaz Isaev wrote:

> 

> > No. But, in fact, it can be done using QHA, though it

> is not included

> > in its current version.

> 

> v.4.2 of QE includes QHA, as far as I know

> 

> P.

> -- 

> Paolo Giannozzi, Democritos and University of Udine, Italy

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> 





   



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