[Pw_forum] transition

Mansoureh Pashangpour mansourehp at gmail.com
Wed Aug 5 07:50:54 CEST 2009


Dear all
I have perorm GGA+U for a system with trigonally distorted  (D3d)  of
octahedral
symmetry (MO6) (with orbital 3d6).
using PDOS for this system perdict two transition. How can I find which
transion is allowed or forbbiden?

I am looking forward to hearing from you.

Mansoureh Pashangpour

Islamic Azad University
Science & Reaserch Branch,
Tehran, Iran.
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