journal article·2016-03-15Open access

Vibrationally dependent electron-electron interactions in resonant electron transport through single-molecule junctions

A. Erpenbeck, R. Härtle, M. Bockstedte, M. Thoss

Physical Review B· Volume 93· Issue 11

Abstract

We investigate the role of electronic-vibrational coupling in resonant electron transport through single-molecule junctions, taking into account that the corresponding coupling strengths may depend on the charge and excitation state of the molecular bridge. Within an effective-model Hamiltonian approach for a molecule with multiple electronic states, this requires to extend the commonly used model and include vibrationally dependent electron-electron interaction. We use Born-Markov master equation methods and consider selected models to exemplify the effect of the additional interaction on the transport characteristics of a single-molecule junction. In particular, we show that it has a significant influence on local cooling and heating mechanisms, it may result in negative differential resistance, and it may cause pronounced asymmetries in the conductance map of a single-molecule junction.
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Research context

OpenAlex topics: Molecular Junctions and Nanostructures · Quantum and electron transport phenomena · Nanowire Synthesis and Applications

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