[Pw_forum] Problems about QHA

Eyvaz Isaev eyvaz_isaev at yahoo.com
Thu Apr 28 19:25:25 CEST 2011


Dear Zafar,

OK, I will contact you as soon as possible.

Best regards,
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: zafar rasheed <zafartariq2003 at yahoo.com>
To: pw_forum at pwscf.org
Cc: pw_forum-request at pwscf.org
Sent: Thu, April 28, 2011 8:45:23 PM
Subject: [Pw_forum] Problems about QHA






>Dear Eyvaz Isaev
> 
>We have just started use Quantum Espresso (since one years ago) . We want to 
>calculat thermal properties (coefficient of thermal expansion, Cp, Cv etc.). But 
>we can not create *.x  files of QHA folder. We are using Fedora core 7 (on 
>Simple P4 computer having 2GHz processor , 256 RAM) having gfortran compiler. We 
>change FC in Makefile ( ifort to gfortran) but*.x  files does not work. Please 
>help us in this aspect. 
> 
>Best Regards
> 
>Zafar Rasheed
> 
>PhD Student
>Department of Physics
> 
>The Islamia University of Bahawalpur, Pakistan  
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