[Pw_forum] ph.x

Eyvaz Isaev eyvaz_isaev at yahoo.com
Sat Jan 31 00:24:44 CET 2009


Dear Alvaro,

Have you changed any parameter in the example file?  Is your calculation parallel or serial?

Based on quite scarcy information you posted I think no one can help you. Posting your script or giving more information will be helpful. 

Bests,
Eyvaz. 

-------------------------------------------------------------------
Prof. Eyvaz Isaev, 
Theoretical Physics Department, Moscow State Institute of Steel & Alloys, Russia, 
Department of Physics, Chemistry, and Biology (IFM), Linkoping University, Sweden 
Condensed Matter Theory Group, Uppsala University, Sweden 
Eyvaz.Isaev at fysik.uu.se, isaev at ifm.liu.se, eyvaz_isaev at yahoo.com


--- On Sat, 1/31/09, Álvaro Alves <asafis at yahoo.com.br> wrote:

> From: Álvaro Alves <asafis at yahoo.com.br>
> Subject: [Pw_forum] ph.x
> To: "pw" <pw_forum at pwscf.org>
> Date: Saturday, January 31, 2009, 12:10 AM
> Hi all. I´m trying to run ph.x for AlAs (to get phonon
> frequencies at gamma point only). The mode #  1 is done,
> but the mode #  2 don´t converge. What may be happening ?
> 
> A. S. Santos
> 
> 
>       Veja quais são os assuntos do momento no Yahoo!
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