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Modeling Challenges in Molecular Electronics on Silicon

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Abstract

Molecular electronics on silicon substrates hold promise for new functional possibilities on silicon. One such possibility is a hybrid silicon-molecule device that shows negative differential resistance (NDR) when conduction through the molecular levels are cut-off as the levels are driven into the silicon band-gap region. We demonstrate through a self-consistent solution based on Non-equilibrium Green’s Function (NEGF) formalism that the NDR peaks show a clear polarity dependence, appearing for only positive bias on a p-doped substrate. We further discuss what determines the position of the NDR peaks and how the locations are affected by self-consistency.

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Correspondence to T. Rakshit.

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Rakshit, T., LIANG, G.C., Ghosh, A.W. et al. Modeling Challenges in Molecular Electronics on Silicon. J Comput Electron 4, 83–86 (2005). https://doi.org/10.1007/s10825-005-7113-x

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  • DOI: https://doi.org/10.1007/s10825-005-7113-x

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