[CP2K-user] [CP2K:16525] how to preserve a bond during MD/OPT

Geng sungengemail at foxmail.com
Sat Jan 29 01:49:32 UTC 2022

Dear CP2k users,
I wonder how to add an external force field on selected pairs of atoms 
(such as spring forces), so I can preserve the bond between atoms.?
Thank you very much in advance.

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/3df4cfce-ff8d-4dca-9ae0-6404277ee3bcn%40googlegroups.com.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220128/41e0e812/attachment.htm>

More information about the CP2K-user mailing list