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Re: [abinit-forum] Phonon Eigendisplacement


Chronological Thread 
  • From: Xavier Gonze <xavier.gonze@uclouvain.be>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] Phonon Eigendisplacement
  • Date: Thu, 28 Jan 2010 16:48:03 +0100


On 25 Jan 2010, at 22:23, Lai Jiang wrote:

Dear all,

After a phonon calculation at Gamma point how could I obtain the phonon
eigendisplacements? It seems the output file only contains eigenfrequencies.

??
See tests/v2/Refs/t21.out as an example : eigendisplacements
are between lines 339 and 517 . There are plenty of examples
in the tests directory of ABINIT.

X.

I
tried to use anaddb (activate eivec=1 and nothing else in the anaddb input
file) but it only gives me effective charge tensors... Is there any other
options I need to turn on in the anaddb input file or is it possible to get
eigendisplacements right from the abinit run?

Thank you in advance.




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