[CP2K-user] [CP2K:17051] How to print information only once in GEO_OPT?

[方书成]

Hello everyone,

I'm trying to do a GEO_OPT task with CP2K and print the CBM and VBM 
wavefunctions. CP2K prints the wavefunction at the end of every geo_opt 
step and produces a lot of useless files. Is there a way to make it print 
the wavefunction only once, by the end of the entire geo_opt loop? 

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