[DFTB-Plus-User] External electric field
SRKC Sharma Yamijala
sharmajncasr at gmail.com
Mon Apr 20 11:42:11 CEST 2015
Hi
Can anybody through some light on this?
Thanks,
Sharma.
********************************************************
*Chaitanya Sharma,*
*Prof. Pati'*s group,
Chemistry and Physics Materials unit,
JNCASR, BANGLORE,
Lab:: (080-2208) 2581, 2809
https://sites.google.com/site/sharmasrkcyamijala/
*********************************************************
On Fri, Mar 27, 2015 at 11:12 AM, SRKC Sharma Yamijala <
sharmajncasr at gmail.com> wrote:
> Dear all,
>
> I would like to know how the effect of electric-field is implemented in
> DFTB+. Can I get some relevant papers. Does the term goes as "-eEr" in the
> Hamiltonian?
>
> I saw Dr. Balint's paper on Lanthanides.
>
> Sincerely,
> Sharma.
>
>
>
>
>
> ********************************************************
> *Chaitanya Sharma,*
> *Prof. Pati'*s group,
> Chemistry and Physics Materials unit,
> JNCASR, BANGLORE,
> Lab:: (080-2208) 2581, 2809
> https://sites.google.com/site/sharmasrkcyamijala/
> *********************************************************
>
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