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Search for "molecular junction electron transport density functional theory molecular devices" in Full Text gives 1 result(s) in Beilstein Journal of Nanotechnology.

Effects of electronic coupling and electrostatic potential on charge transport in carbon-based molecular electronic junctions

Richard L. McCreery

Beilstein J. Nanotechnol. 2016, 7, 32–46, doi:10.3762/bjnano.7.4

difficult to calculate accurately, it does provide a basis for the “vacuum level shift” observed in many experiments, including transport and ultraviolet photoelectron spectroscopy of molecular layers on conductors. Keywords: molecular junction electron transport density functional theory molecular devices

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Published 11 Jan 2016

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