[CP2K-user] Fix graphene sheets harmonically

charitha perera perer... at gmail.com
Fri Feb 12 01:32:16 UTC 2021

Hello all,
I'm very new to cp2k. I just started a project to do an AIMD study of a
water layer in between two graphene sheets. I followed the given exercise
on the cp2k website. I want to fix the graphene sheets. Does anyone know
how to fix them harmonically?

Thank you in advance

D.Charitha Perera
Doctoral Candidate, Chemistry
Treasurer -GSG (UMaine)
Executive Committee - FGSA, FOEP (APS)
University of Maine
Orono, ME 04469
charith... at maine.edu
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