[CP2K-user] [CP2K:20642] High pressure calculation

[Cheng]

Dear all,

I want to get the band structure of a solid crystal under high pressure. Is 
there a way in CP2K to setting the external pressur eand obtaining the 
energy under than pressure? 

Thanks and best regards,
Cheng

-- 
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/704437c5-7aa4-4993-a6d8-07a1f1643ecen%40googlegroups.com.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20240831/d98a68bb/attachment-0001.htm>