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how to calculate surface and oxide


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  • From: gwcong@semi.ac.cn
  • To: forum@abinit.org
  • Subject: how to calculate surface and oxide
  • Date: Tue, 20 Apr 2004 17:36:12 +0200

Dear Abinit users,

Is there anybody who are familar with surface calculation and oxides ab
initio research using abinit? I donot know whether abinit can do this? The
oxides includes ZnO or Fe2O3 etc. And how to creat the surface cell,
especially the interface between different films, such as ALAS/GaAs? I really
need your advice.

Thank you very much for your kindness and assistance.

Sincerely,

Guangwei Cong


  • how to calculate surface and oxide, gwcong, 04/20/2004

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