Hi,
I have one question: for spin-orbit calculations, the energy bands are
labelled with double point group notation (D3d? in my case).
Some of the energy-degenerate states have different irrep labels and I
wonder why?
e.g. the valence band top:
e( 45 - 46) = 7.09176 eV 2 --> G_5+ L_4+
e( 45 - 46) = 7.09176 eV 2 --> G_6+ L_5+
I would be grateful for your reply or some literature reference, as I am not
familiar with the group theory.
Many thanks,
Silvia
----------------------
Dr. Silvia Bakalova,
Post Doctoral Researcher,
HH Wills Physics Laboratory,
Bristol, BS8 1TL, UK
http://spectra.phy.bris.ac.uk/
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