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- From: Marcel Mohr <marcel@physik.tu-berlin.de>
- To: forum@abinit.org
- Subject: Re: [abinit-forum] phonon eigenvectors
- Date: Thu, 12 Apr 2007 16:30:20 +0200 (CEST)
Dear Francesco
On Thu, 12 Apr 2007, bertazzi@bu.edu wrote:
Dear Colleagues,
I am using the anaddb code to interpolate phonon dispersions in wurtzite
crystals; I need the phonon eigenvectors outside of the first Brillouin zone
(1BZ).
I would like to know if these phonon eigenvectors are interpolated correctly
by the anaddb program. It looks like phonon eigenvectors outside of the 1BZ
are the same as the eigenvectors computed for reduced wave vectors inside the
1BZ.
Hopefully they are the same. Why should they differ in a potential where U(k+G)=U(k) ?
Cheers Marcel
- phonon eigenvectors, bertazzi, 04/12/2007
- Re: [abinit-forum] phonon eigenvectors, Marcel Mohr, 04/12/2007
- about virtual crystal approximation, Wu Rongqin, 04/12/2007
- Makefile for Atompaw, Pascal Rausch, 04/12/2007
- Re: [abinit-forum] Makefile for Atompaw, Anglade Pierre-Matthieu, 04/12/2007
- Re: [abinit-forum] Makefile for Atompaw, Chol-Jun Yu, 04/12/2007
- Re: [abinit-forum] Makefile for Atompaw, Pascal Rausch, 04/12/2007
- Re: [abinit-forum] Makefile for Atompaw, Anglade Pierre-Matthieu, 04/12/2007
- 答复: [abinit-forum] Makefile for Atompaw, Wu Rongqin, 04/13/2007
- Re: [abinit-forum] Makefile for Atompaw, Pascal Rausch, 04/12/2007
- Re: [abinit-forum] Makefile for Atompaw, Chol-Jun Yu, 04/12/2007
- Re: [abinit-forum] Makefile for Atompaw, Anglade Pierre-Matthieu, 04/12/2007
- Re: [abinit-forum] phonon eigenvectors, Marcel Mohr, 04/12/2007
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