[CP2K-user] [CP2K:17068] default Force Units
Victor Volkov
volkovskr at gmail.com
Wed Jun 1 20:01:31 UTC 2022
Dear members and developers:
I wish to ask about the default units for FORCE when asked for using
&FORCES ON
&EACH
MD 1
&END EACH
&END FORCES
Should I expect Hartree/bohr as in wiki
https://en.wikipedia.org/wiki/Hartree_atomic_units
Below I provide the available online description.
Thank you
Best wishes,
Victor
*************
Force Possible units of measurement for forces.
The [force] entry acts like a dummy flag (assumes the unit of measurement
of force is in internal units), useful for dimensional analysis.
*N*
*Newton*
*mN*
*mNewton*
*au_f* *force*
--
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/910143f6-d381-4683-bfeb-4f407e69dc97n%40googlegroups.com.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220601/953e07d1/attachment.htm>
More information about the CP2K-user
mailing list