[DFTB-Plus-User] How to get the LUMO and HOMO for carbon nanotube?

[Bálint Aradi]

On 12/17/2012 10:21 AM, 张超 wrote:
> Dear all,
>  How to get the LUMO and HOMO for carbon nanotube? According to the PlottedLevels?  
> Thank you!

 You look aat the occupations in band.out.

  Best regards,

  Bálint

-- 
Dr. Bálint Aradi
Bremen Center for Computational Materials Science, University of Bremen
http://www.bccms.uni-bremen.de/cms/people/b_aradi/


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