[CP2K-user] [CP2K:17526] VIBRATIONAL_ANALYSIS: Direction of normal modes

shreya singh shrsingh183 at gmail.com
Mon Aug 22 07:03:58 UTC 2022


Dear CP2K users,
What does the X,Y,Z components of the normal modes output obtained 
corresponds to:
(a) direction of lattice vectors, or (b) cartesian directions ?

Regards
Shreya

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