[CP2K-user] [CP2K:21842] phase information on overlaps and couplings from CDFT calculations

Jason Howard howardjason8 at gmail.com
Mon Sep 22 01:38:47 UTC 2025


Hi all I hope you are doing well.  Is it possible to get the phase 
information about the couplings and overlaps from the CDFT calculations?

Thanks so much. 

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