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Re: [abinit-forum] problem


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  • From: Hua Bao <hbao@purdue.edu>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] problem
  • Date: Mon, 15 Oct 2007 10:39:35 -0400

Why not assume all the valence bands are occupied?

m_mousavi1980@yahoo.com wrote:
Dear abinit users,
Thanks a lot for your attentions. I want to calculate, number of electrons in
valence band for In2O3 with 80 atoms in unit cell. How can I calculate, the
number of electrons in valence band for In2O3?
Thank you for any suggestion in advanced.





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