[CP2K-user] Interaction potential

Antonis Evang antoni... at gmail.com
Tue Mar 30 20:04:44 UTC 2021


Hello everyone,

I am trying to run a Pt(111)-BP1 surface QM/MM simulation and I can't find 
the interaction potential between different atoms  (e.g LJ interaction 
between C-Pt, O-Pt, N-Pt etc.) Does anyone have any idea where can I find 
this information?

Thank you in advance!

Best regards,
Antonis
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