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by qq81816276
Fri Oct 21, 2022 2:46 am
Forum: General discussion
Topic: How to identify phonon mode
Replies: 0
Views: 7806

How to identify phonon mode

Dear developers, My system is planar Mn2B2. There are 4 atoms in the unitcell. so there are 12 modes. 3 modes in x/y/z direction for each atoms. First I run the ph.x to get the phonon spectra as below in figure 01. I know the first column is k-path, but how can I know the last 12 columns, which ...