Outputs (3)

Heteroatom Effects on Quantum Interference in Molecular Junctions: Modulating Antiresonances by Molecular Design (2021)
Journal Article
O’Driscoll, L. J., Sangtarash, S., Xu, W., Daaoub, A., Hong, W., Sadeghi, H., & Bryce, M. R. (2021). Heteroatom Effects on Quantum Interference in Molecular Junctions: Modulating Antiresonances by Molecular Design. Journal of Physical Chemistry C, 125(31), 17385-17391. https://doi.org/10.1021/acs.jpcc.1c04242

Controlling charge transport through molecular wires by utilizing quantum interference (QI) is a growing topic in single-molecular electronics. In this article, scanning tunneling microscopy-break junction techniques and density functional theory cal... Read More about Heteroatom Effects on Quantum Interference in Molecular Junctions: Modulating Antiresonances by Molecular Design.

A review of oligo(arylene ethynylene) derivatives in molecular junctions (2021)
Journal Article
O'Driscoll, L. J., & Bryce, M. R. (2021). A review of oligo(arylene ethynylene) derivatives in molecular junctions. Nanoscale, 13(24), 10668-10711. https://doi.org/10.1039/d1nr02023d

Oligo(arylene ethynylene) (OAE) derivatives are the “workhorse” molecules of molecular electronics. Their ease of synthesis and flexibility of functionalisation mean that a diverse array of OAE molecular wires have been designed, synthesised and stud... Read More about A review of oligo(arylene ethynylene) derivatives in molecular junctions.

Extended curly arrow rules to rationalise and predict structural effects on quantum interference in molecular junctions (2021)
Journal Article
O'Driscoll, L. J., & Bryce, M. R. (2021). Extended curly arrow rules to rationalise and predict structural effects on quantum interference in molecular junctions. Nanoscale, 13(2), 1103-1123. https://doi.org/10.1039/d0nr07819k

The ability to easily and reliably predict quantum interference (QI) behaviour would facilitate the design of functional molecular wires with potential applications in switches, transistors and thermoelectric devices. A variety of predictive methods... Read More about Extended curly arrow rules to rationalise and predict structural effects on quantum interference in molecular junctions.