Dipoles are widely involved in π–π interactions and are central to many chemical and
biological functions, but their influence on the strength of π–π interactions remains unclear …

The charge transport through supramolecular junctions exhibits unique quantum
interference (QI) effects, which provide an opportunity for the design of supramolecular …

Energy transfer and exciplex emission are not only crucial photophysical processes in many
living organisms but also important for the development of smart photonic materials. We …

Most studies in molecular electronics focus on altering the molecular wire backbone to tune
the electrical properties of the whole junction. However, it is often overlooked that the …

An accurate rule for predicting conductance is the cornerstone of developing molecular
circuits and provides a promising solution for miniaturizing electric circuits. The successful …

This study presents systematic theoretical investigations employing an ab initio DFT
approach combined with analysis of heuristic tight-binding models. We examine the effect of …

Future applications of single‐molecular and large‐surface area molecular devices require a
thorough understanding and control of molecular junctions, interfacial phenomena, and …

Quantum interference (QI) plays a crucial role in determining the charge transport in
molecular devices. In this work, the efficient modulation of QI in meta‐phenylene ethylene …

Molecular electronics is a field of research and technology that focuses on electronic
devices which use individual molecules, nanoscale assemblies of molecules or ultrathin …

The development of next-generation batteries and smart electronic devices relies on the
design of new organic redox-active materials. However, the performance of electronic …