English

The Jahn-Teller effect and spin--orbit coupling: friends or foes?

Strongly Correlated Electrons 2020-08-26 v1 Materials Science Quantum Physics

Abstract

The Jahn-Teller effect is one of the most fundamental phenomena important not only for physics, but also for chemistry and material science. Solving the Jahn-Teller problem and taking into account strong electron correlations we show that quantum entanglement of the spin and orbital degrees of freedom via spin--orbit coupling strongly affects this effect. Depending on the number of dd electrons it may quench (electronic configurations t2g2t_{2g}^2, t2g4t_{2g}^4, and t2g5t_{2g}^5), partially suppress (t2g1t_{2g}^1) or in contrast induce (t2g3t_{2g}^3) Jahn-Teller distortions. Moreover, in certain situations, interplay between the Jahn-Teller effect and spin--orbit coupling promotes formation of the "Mexican hat" energy surface facilitating various quantum phenomena.

Keywords

Cite

@article{arxiv.2006.03097,
  title  = {The Jahn-Teller effect and spin--orbit coupling: friends or foes?},
  author = {S. V. Streltsov and D. I. Khomskii},
  journal= {arXiv preprint arXiv:2006.03097},
  year   = {2020}
}
R2 v1 2026-06-23T16:04:07.055Z