[CP2K-user] [CP2K:20530] CPASSERT in topology while running metadynamic

Pierre Beaujean pierreb24 at gmail.com
Sat Aug 3 13:05:15 UTC 2024


Hi, 

I'm trying to perform a metadynamic using 3 collectives variables. However, 
I get a CPASSERT error coming from colvar_utils.F:611. Input and output are 
provided here: 
https://gist.github.com/pierre-24/8eb85ba711c3c992d00a169d2cd066a0

Anyone has an idea? Thanks in advance :)

Pierre

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