ask for help to prepare an input file and run a simulation

Florian Schiffmann flosch... at gmail.com
Mon Sep 29 14:44:41 UTC 2014


Hi, 

not sure whether there was a typo or not. In case you want to run CPMD 
(Car-Parinello molecular dynamics), this is not possible with CP2K. We only 
have Born Oppenheimer MD implemented.

Cheers
Flo
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