[CP2K-user] [CP2K:20138] The problem of utilizing CP2K for the calculation of Raman activity
rongz ma
marongzhi2000 at gmail.com
Mon Apr 29 02:19:12 UTC 2024
Dear CP2K users,
I intended to employ CP2K for the computation of Raman activity, and
indeed, I successfully completed the calculation. However, all the obtained
Raman activities were displayed as "*******". The reason behind this
discrepancy remains unknown to me; hence, I kindly request assistance from
the community.
Best regards,
Rongz Ma
[image: 89ed92adf5ff8ee95945b0c384479db7.png]
--
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/7b606785-40c5-4d5c-904f-51fd460997bfn%40googlegroups.com.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20240428/eb0b7ae0/attachment-0001.htm>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: 89ed92adf5ff8ee95945b0c384479db7.png
Type: image/png
Size: 32133 bytes
Desc: not available
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20240428/eb0b7ae0/attachment-0001.png>
More information about the CP2K-user
mailing list