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Phys. Rev. B 76, 174305 (2007) [9 pages]

Single-polaron properties of the one-dimensional breathing-mode Hamiltonian

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Bayo Lau, Mona Berciu, and George A. Sawatzky
Department of Physics and Astronomy, University of British Columbia, Vancouver, British Columbia, Canada V6T 1Z1

Received 20 August 2007; published 21 November 2007

We investigate numerically various properties of the one-dimensional (1D) breathing-mode polaron. We use an extension of a variational scheme to compute the energies and wave functions of the two lowest-energy eigenstates for any momentum, as well as a scheme to compute directly the polaron’s Green’s function. We contrast these results with the results for the 1D Holstein polaron. In particular, we find that the crossover from a large to a small polaron is significantly sharper. Unlike for the Holstein model, at moderate and large couplings, the breathing-mode polaron dispersion has nonmonotonic dependence on the polaron momentum k. Neither of these aspects is revealed by a previous study based on the self-consistent Born approximation.

© 2007 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevB.76.174305
DOI:
10.1103/PhysRevB.76.174305
PACS:
71.38.−k, 72.10.Di, 63.20.Kr