It's a Trap: Studying the quantum dot surface on an atomistic scale

Due to their size-dependent properties, high photoluminescence quantum yield and relatively cheap solution-based processing, colloidal quantum dots (QDs) are of great interest for application in optoelectronic devices. However, the efficiency of these devices is often limited by the presence of trap states: localized electronic states that lead...

Surface Reconstructions in II-VI Quantum Dots

Although density functional theory (DFT) calculations have been crucial in our understanding of colloidal quantum dots (QDs), simulations are commonly carried out on QD models that are significantly smaller than those generally found experimentally. While smaller models allow for efficient study of local surface configurations, increasing the...