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Re: [abinit-forum] anaddb & rprim

From: zahra hooshmand <z.hooshmand@gmail.com>
To: forum@abinit.org
Subject: Re: [abinit-forum] anaddb & rprim
Date: Thu, 10 Dec 2009 19:26:28 +0330
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Hi,
do you know how can I use qptdm and nqptdm for example for a 8 q point calculation? then, how can I merge them?
Please help me!
Best
Zahra

On Thu, Dec 10, 2009 at 7:22 PM, <bertazzi@bu.edu> wrote:

Dear all,

The rprim variable for the Hexagonal lattice has to be 1.0 0.0 0.0 -.5
sqrt(3)/2 0.0 0.0 0.0 1.0 in order for the ANADDB code to work properly. I
would like to know if it is possible to obtain the phonon eigenvectors for
another set of primitive vectors from the eigenvectors computed by ANADDB. Any
help is appreciated!

Best Regards, Francesco Bertazzi

--
Regards
Zahra Hooshmand

[abinit-forum] anaddb & rprim, bertazzi, 12/10/2009
- Re: [abinit-forum] anaddb & rprim, zahra hooshmand, 12/10/2009
- Re: [abinit-forum] anaddb & rprim, jinhong zhang, 12/22/2009