Modeling electrostatic response in classical MD for metal-liquid interface

Prasenjit Ghosh prasen... at
Wed Jun 21 16:00:46 UTC 2017

Dear all,

I was wondering whether Siepmann and Sprik's method of modeling 
electrostatic induction has been implemented in cp2K (J. Chem Phys, 102, 
511 (1995)). I saw the flags related to Siepmann-Sprik's potential in the 
manual and the tests. However, I did not find any input parameters related 
to modeling the excess charge density related to metal ions. May be I am 
missing something.

Can someone please direct me towards the right direction?

With regards,

IISER Pune, India
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <>

More information about the CP2K-user mailing list