[Pw_forum] C_v calculations

Eyvaz Isaev eyvaz_isaev at yahoo.com
Tue May 25 22:51:53 CEST 2010


Dear Eli,

See QHA in QuantumESPRESSO v.4.2.

More questions, please let me know.

Please provide your affiliation, too.

Bests, 
Eyvaz.
P.S. I have noticed many times that people who submits a question is not worried about the Subject or  mail content is completely different from the subject. Evidently, this may cause not responding to a  message or late respond.

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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

--- On Tue, 5/25/10, eli <elahe_afrodit at yahoo.com> wrote:

From: eli <elahe_afrodit at yahoo.com>
Subject: [Pw_forum] (no subject)
To: pw_forum at pwscf.org
Date: Tuesday, May 25, 2010, 3:17 PM

Dear All



I have attempted to calculate the specific heat  from phonon dos  as an input.
how do i calculate C-v with out deby model?  










      
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