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arxiv: 0711.1088 · v2 · submitted 2007-11-07 · ❄️ cond-mat.mes-hall

Modeling extended contacts to nanotube and graphene devices

classification ❄️ cond-mat.mes-hall
keywords allowcalculationsgrapheneinterfacemodelsvariousanalyticarbitrary
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Carrier injection into carbon nanotubes and graphene nanoribbons, contacted by a metal coating over an arbitrary length, is studied by various means: Minimal models allow for exact analytic solutions which can be transferred to the original system with high precision. Microscopic ab initio calculations of the electronic structure at the carbon-metal interface allow us to extract -- for Ti and Pd as contacting materials -- realistic parameters, which are then used in large scale tight-binding models for transport calculations. The results are shown to be robust against nonepitaxially grown electrodes and general disorder at the interface, as well as various refinements of the model.

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