Modeling Molecular Junctions: Weak and Strong Coupling Regimes

Electron transport through single molecule connected to the electrodes is an interesting problem from a fundamental point of view, and because of possible applications. From the theoretical point of view, the hope is that understanding the transport phenomena in such systems enables us to explain measurements and develop devices with new...

Modeling level alignment at interfaces in molecular junctions

Molecular devices are planned as alternative solutions for heat dissipation problems and reliable fabrication of nano-scale devices. However, it also opens up possibilities of combining many other degrees of freedom into functional device design. While they introduce interesting opportunities for study, they also demand a versatile, scalable...