[CP2K-user] Vibrational analysis of CO

[sumit agrawal]

Hii,

I want to calculate the vibrational frequency of CO molecule. I am using
the TZVP-MOLOPT-GTH basis set for C and O and GTH pseudopotential.  PBE-D3
correction has been added.

I got the frequency 2307 cm-1. But I am not able to get the exact frequency
which is referred to in the attached paper.

Here I am watching my input and out files.

Please help me with this!!!
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