[CP2K-user] [CP2K:18787] Coupling Force Evaluations: Coupled Type

Josh W jwheels91 at gmail.com
Tue May 9 21:01:46 UTC 2023

I'm looking at this section of the manual where it defines how the coupling 
of force enviornments in handled:


   - *Coupling between two force_eval: E=(E1+E2 - 

What exactly is H12? Is this spin orbit coupling, something related, or a 
parameter of our choosing? 

Any information or sources would be appreciated!
Thank you!

You received this message because you are subscribed to the Google Groups "cp2k" group.
To unsubscribe from this group and stop receiving emails from it, send an email to cp2k+unsubscribe at googlegroups.com.
To view this discussion on the web visit https://groups.google.com/d/msgid/cp2k/6fcbaf6a-920f-4056-a3b5-62d6afb6f2c7n%40googlegroups.com.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20230509/cba0b4ca/attachment.htm>

More information about the CP2K-user mailing list