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rhombohedral phono band structure


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  • From: Mustafa Uludogan <uludoganmustafa@yahoo.com>
  • To: abinit <forum@abinit.org>
  • Subject: rhombohedral phono band structure
  • Date: Tue, 18 Apr 2006 22:52:43 -0700 (PDT)
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Hi
I am trying to plot phonon band structure of rhombohedral phase with anaddb for BaTiO3. As far as I know , anaddb does not support  rhombohedral bravais lattice  .
Is there any way around to play with this?  I  also suspect that there is a discontiunity problem for the modes at gamma point while reaching gamma from different directions.
Yours Sincerely
 


Mustafa Uludogan
Chemical Engineering Department
Texas A&M University
College Station, TX 77843


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