Single-molecule electronics: from chemical design to functional devices
L Sun, YA Diaz-Fernandez, TA Gschneidtner… - Chemical Society …, 2014 - pubs.rsc.org
The use of single molecules in electronics represents the next limit of miniaturisation of
electronic devices, which would enable us to continue the trend of aggressive downscaling …
electronic devices, which would enable us to continue the trend of aggressive downscaling …
Basic concepts of quantum interference and electron transport in single-molecule electronics
CJ Lambert - Chemical Society Reviews, 2015 - pubs.rsc.org
This tutorial outlines the basic theoretical concepts and tools which underpin the
fundamentals of phase-coherent electron transport through single molecules. The key …
fundamentals of phase-coherent electron transport through single molecules. The key …
Observation of quantum interference in molecular charge transport
As the dimensions of a conductor approach the nanoscale, quantum effects begin to
dominate, and it becomes possible to control the conductance through direct manipulation of …
dominate, and it becomes possible to control the conductance through direct manipulation of …
Antioxidant Activity of trans-Resveratrol toward Hydroxyl and Hydroperoxyl Radicals: A Quantum Chemical and Computational Kinetics Study
In this work, we have carried out a systematic study of the antioxidant activity of trans-
resveratrol toward hydroxyl (• OH) and hydroperoxyl (• OOH) radicals in aqueous simulated …
resveratrol toward hydroxyl (• OH) and hydroperoxyl (• OOH) radicals in aqueous simulated …
Realignment of local and charge-transfer excited states in promoting room-temperature phosphorescence of organic aggregates
J Fang, P Li, X Xue, H Li, D Cui, J Zhang… - Chemistry of …, 2023 - ACS Publications
Aggregation significantly affects the organic room-temperature phosphorescence (RTP),
especially in molecules with donor (D)–acceptor (A) architectures but is yet to be rationally …
especially in molecules with donor (D)–acceptor (A) architectures but is yet to be rationally …
Bridge-mediated charge separation in isomeric N-annulated perylene diimide dimers
The possibility and rate of charge separation (CS) in donor–bridge–acceptor molecules
mainly depend on two factors: electronic coupling and solvent effects. The question of how …
mainly depend on two factors: electronic coupling and solvent effects. The question of how …
Evidence for quantum interference in SAMs of arylethynylene thiolates in tunneling junctions with eutectic Ga–In (EGaIn) top-contacts
D Fracasso, H Valkenier, JC Hummelen… - Journal of the …, 2011 - ACS Publications
This paper compares the current density (J) versus applied bias (V) of self-assembled
monolayers (SAMs) of three different ethynylthiophenol-functionalized anthracene …
monolayers (SAMs) of three different ethynylthiophenol-functionalized anthracene …
Cross-conjugation and quantum interference: a general correlation?
We discuss the relationship between the π-conjugation pattern, molecular length, and
charge transport properties of molecular wires, both from an experimental and a theoretical …
charge transport properties of molecular wires, both from an experimental and a theoretical …
Challenges and opportunities in the development of conjugated block copolymers for photovoltaics
Fully conjugated block copolymers that covalently link donor and acceptor units within the
molecular structure have the potential to simultaneously control the mesoscale assembly …
molecular structure have the potential to simultaneously control the mesoscale assembly …
Magic ratios for connectivity-driven electrical conductance of graphene-like molecules
Y Geng, S Sangtarash, C Huang… - Journal of the …, 2015 - ACS Publications
Experiments using a mechanically controlled break junction and calculations based on
density functional theory demonstrate a new magic ratio rule (MRR) that captures the …
density functional theory demonstrate a new magic ratio rule (MRR) that captures the …