[CP2K-user] TDDFT Davidson interaction restart

Andres Ortega oandr... at gmail.com
Mon Oct 7 14:05:55 UTC 2019


Dear CP2K users, 

I was wondering if there is a change to control the Restart of the Davidson 
interaction while doing TDDFT calculations in CP2K 6.1.
I thought that increasing the MAX_KV parameter in PROPERTIES/ TDDFPT will 
do the work, however, this is not the case?

thank you in advance

Andres Ortega
LSMO EPFL
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