[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]

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