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arXiv:cond-mat/0105166 · The European Physical Journal B

An analytic study of the E ⊗ e Jahn-Teller polaron

H. Barentzen

Published Nov 1, 2001• 10 citations
arXivHTMLPDF
DOI
10.1007/s100510170007

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The properties of the polaron and bipolaron are explored in the one-dimensional Jahn-Teller model with dynamical quantum phonons. The ground-state properties of the polaron and bipolaron are computed using a recently developed variational method. Dynamical properties of the ground state of a polaron are investigated by calculating the optical conductivity $\ensuremath{\sigma}(\ensuremath{\omega}).$ Our numerical results suggest that the Jahn-Teller and Holstein polarons are similar. However, in the strong-coupling regime qualitative differences in $\ensuremath{\sigma}(\ensuremath{\omega})$ between the two models are found and discussed. The influence of the electron-phonon coupling and the electrostatic repulsion on the bipolaron binding energy, bipolaron masses, and correlation functions is investigated.

arXiv:cond-mat/0211099•Physical review. B, Condensed matter•Jan 10, 2003•29 citations
Based on an exact expression for the self-energy of the Jahn-Teller polaron, we find that symmetry of pseudospin rotation makes the vertex correction much less effective than that for the Holstein polaron. This ineffectiveness brings about a smaller effective mass m∗{m}^{*}m∗ and a quantitatively different large-to-small polaron crossover, as examined by exact diagonalization in a two-site system. In the strong-coupling and antiadiabatic region, a rigorous analytic expression is found for m∗.{m}^{*}.m∗.
A path-integral representation for the Jahn-Teller polaron (JTP) is constructed. It leads to a perturbation series that can be summed exactly by the diagrammatic quantum Monte Carlo technique. The ground-state energy, effective mass, spectrum, and density of states of the three-dimensional JTP are calculated with no systematic errors. The band structure of JTP is found to be similar to that of the Holstein polaron. The mass of JTP increases exponentially with the coupling constant. At small phonon frequencies, the spectrum of JTP is flat at large momenta, which leads to a strongly distorted density of states with a massive peak at the top of the band.
The properties of the polaron and bipolaron are explored in the one-dimensional Jahn-Teller model with dynamical quantum phonons. The ground-state properties of the polaron and bipolaron are computed using a recently developed variational method. Dynamical properties of the ground state of a polaron are investigated by calculating the optical conductivity $\ensuremath{\sigma}(\ensuremath{\omega}).$ Our numerical results suggest that the Jahn-Teller and Holstein polarons are similar. However, in the strong-coupling regime qualitative differences in $\ensuremath{\sigma}(\ensuremath{\omega})$ between the two models are found and discussed. The influence of the electron-phonon coupling and the electrostatic repulsion on the bipolaron binding energy, bipolaron masses, and correlation functions is investigated.