[CP2K-user] [CP2K:15559] Doubt regarding the input file

Nikhil Maroli scin... at gmail.com
Mon Jun 14 12:34:33 UTC 2021


On Mon, 14 Jun 2021, 17:52 Upasana Nath, <upa... at gmail.com> wrote:

> Dear CP2K user.
> I am a new user of cp2k and  trying to do molecular Dynamics calculation
> of graphene. Can you please suggest to me how to proceed, and how to make
> the input file? is there any GUI or how?
> Your kind response will be highly appreciated.
> Thanks & Regards
> Upasana
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