[Pw_forum] Error in phonon calculation
Eyvaz Isaev
eyvaz_isaev at yahoo.com
Thu Nov 18 15:47:18 CET 2010
Well,
Then most likely, a compiler error. If I remember correctly, recently similar
error with IOTK and the last Intel Compiler was posted. Try earlier version of
IFC, gfortran, or g95 .
I did not suggest that the convergence criteria might cause the error, I just
noticed "it is VERY high".
Bests,
Eyvaz.
________________________________
From: Ali Tavana <tavana.ali at gmail.com>
To: PWSCF Forum <pw_forum at pwscf.org>
Sent: Thu, November 18, 2010 3:13:27 PM
Subject: Re: [Pw_forum] Error in phonon calculation
Dear Prof. Isaev,
Thank you very much for your response. I tried what you suggested but it didn't
solve my problem.
- I use ifort (actually Intel Parallel Studio xe) on a core i7 processor (no
networking)
- Strong convergence criteria is because of the convergency tests . No
correlation have been seen between it's value and the occurring error ;)
The error still exists...
sincerely yours,
Ali
--
Ali Tavana
PhD Candidate,
Magnet Research Lab. (MRL)
Sharif University of Technology,
Tehran, Iran.
Tel: +98 21 6616 4544
Fax:+98 21 4446 0799
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