[DFTB-Plus-User] MoS2 parameters

[Bálint Aradi]

Dear Sharma,

> Below website suggests that there are parameters for MoS2 on the DFTB
> website. Though I am registered user, I couldn't find any such
> parameters there. Does any body know how to get these parameters. 

Unfortunately, that parameter set was not published by its authors on
the DFTB.ORG website yet. You may contact the authors directly.

  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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