[DFTB-Plus-User] How to apply QM/MM selectively?

Ezgi Erdogan ezgierdo at gmail.com
Tue Apr 24 12:30:34 CEST 2012


Dear DFTB+ user,

I would like to have a sample input for how to apply QM/MM but
especially selectively atoms.

Thanks for your help,
Ezgi


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