[Pw_forum] a2F calculation

[Eyvaz Isaev]

Hi,

Definitely, a2Fdos! The first column is \omega, the second one is total a2Fdos, 
others are mode-projected a2Fdos.

Please, provide your affiliation when post a question to the forum. 

Bests,
Eyvaz.
-------------------------------------------------------------------
Prof. Eyvaz Isaev, 
Department of Physics, Chemistry, and Biology (IFM), Linkoping University, 
Sweden 

Theoretical Physics Department, Moscow State Institute of Steel & Alloys, 
Russia, 

isaev at ifm.liu.se, eyvaz_isaev at yahoo.com




________________________________
From: HASAN SAHİN <hasanx at gmail.com>
To: pw_forum at pwscf.org
Sent: Wed, October 27, 2010 10:16:15 PM
Subject: [Pw_forum] a2F calculation

Hi,

I have ben trying to calculate spectral function a2F with respect to phonon 
frequency cm-1.
At the end of my calculation I get the files:

dyna2F, a2Fdos, a2Fq2r

I see that they contain some column data. Which one of these files does contain 
the information of a2F-frequency ?


Hasan Sahin


      
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20101027/2d6c1b47/attachment.html>