[DFTB-Plus-User] Question about extended GFN-xTB parametrization

[Mauro Sgroi]

Dear Ben,
thanks a lot.
This is very good news.
Best regards,
Mauro.

Il giorno ven 4 dic 2020 alle ore 11:25 Ben Hourahine <
benjamin.hourahine at strath.ac.uk> ha scritto:

> Hello Mauro,
>
> the implementation of the GFN1 hamiltonian is being worked on at the
> moment and will be fully integrated for the 21.1 release next Spring.
>
> Regards
>
> Ben
> On 02/12/2020 10:13, Mauro Sgroi wrote:
>
> Dear users,
> I'm new to this mailing list. My name is Mauro Sgroi and I work at Centro
> Ricerche FIAT in Italy.
> I would be interested in the use of the parametrization GFN1-xTB (or the
> GFN2 if possible) but from the dftb+ manual I cannot understand if it can
> be used or not and how to use it.
>
> Maybe it was already discussed on this list.
>
> Could you please give me some guidance?
>
> Thanks in advance and best regards,
> Mauro Sgroi.
>
>
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