D.D. Awschalom, J.-M. Halbout
Journal of Magnetism and Magnetic Materials
We use density-functional theory to calculate the effects of coadsorption near the molecule/electrode junction on the conductance of a molecular wire. We find significant changes in both the density of states of the molecular wire and its conductance; electrostatic effects as well as short-ranged interactions are found to be responsible. It is clear that successful implementation of molecular electronics will require the control of such interactions.
D.D. Awschalom, J.-M. Halbout
Journal of Magnetism and Magnetic Materials
Imran Nasim, Melanie Weber
SCML 2024
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Macromolecules
Revanth Kodoru, Atanu Saha, et al.
arXiv