[Wien] t2g-eg splitting

Vijeta Singh vijetasingh19 at gmail.com
Sat Apr 11 08:22:11 CEST 2015


Dear Wien2k users,

I have a question concerning t2g-eg splitting. Suppose we have an
orthorhombic system LaMnO3 as example. It has both structure Pnma and
Pbnm.  For an orthorhombic system dxy, dyz and dxz are in t2g states and
dx2-y2 and dz2 are in eg states. By using Pnma symmetry i am getting dxy,
dyz and dz2 in t2g states and dxz and dx2-y2 in eg states. What is the
reason behind this?

Thanks & Regards
Vijeta Singh
CSIR-NPL
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