RT propagation and SCCS

Samuel Andermatt samuel.t.... at gmail.com
Wed May 9 15:24:26 UTC 2018


Should work without problems. I have done it myself with the 
POISSON%IMPLICIT%DIELECTRIC keyword (careful to set the default dielectric 
to 1, so you only change it where you explicitly state to have an implicit 
solvent).

On Thursday, April 26, 2018 at 1:07:24 PM UTC+2, Luca wrote:
>
> Dear Developers
>
> I would need to know if cp2k can include an implicit solvent (SCCS 
> keyword)  in a real-time propagation (RT_PROPAGATION.),
> Thank you in advance for your answers.
>
> Best Regards.
> Luca 
>
>
>    
>
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