Nanoscale Dynamical Mean-Field Theory for Molecules and Mesoscopic Devices in the Strong-Correlation Regime

Serge Florens
Phys. Rev. Lett. 99, 046402 – Published 23 July 2007

Abstract

We develop a nanoscale dynamical mean-field theory (nano-DMFT) to deal with strong Coulomb interaction effects in physical systems that are intermediate in size between atoms and bulk materials, taking into account the tunneling into nearby electrodes. Focusing on a simplified treelike geometry, the usual DMFT loop simply stops when the finite lattice is fully covered, starting with an initial seed provided by the electronic environment at the boundary. To illustrate this nano-DMFT, we investigate the disappearance of the quasiparticle weight in a correlated nano object near the Mott transition. In contrast to thermally driven classical phase transitions, quantum effects lead to unexpected oscillations of the order parameter, related to the interference of coherent renormalized quasiparticles. This behavior also implies a spatially inhomogeneous Mott localization process at the nanoscale.

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  • Received 6 February 2007

DOI:https://doi.org/10.1103/PhysRevLett.99.046402

©2007 American Physical Society

Authors & Affiliations

Serge Florens

  • Institut NEEL, CNRS and Université Joseph Fourier, BP 166, 38042 Grenoble Cedex 09, France

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Issue

Vol. 99, Iss. 4 — 27 July 2007

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