Research on heterogeneous single-atom catalysts (SACs) has become an emerging frontier
in catalysis science because of their advantages in high utilization of noble metals, precisely …

The support plays an important role for supported metal catalysts by positioning itself as a
macromolecular ligand, which conditions the nature of the active site and contributes …

Recently, graphene has been extensively researched in fundamental science and
engineering fields and has been developed for various electronic applications in emerging …

Single-atom catalysis is a powerful and attractive technique with exceptional performance,
drastic cost reduction and notable catalytic activity and selectivity. In single-atom catalysis …

Spiro‐OMeTAD is one of the most used hole transport layers (HTLs) in high efficiency n‐i‐p
perovskite solar cells (PSCs). However, due to the unsatisfactory conductivity of pristine …

“Two-dimensional (2D) materials as electrodes” is believed to be the trend for future Li-ion
and Na-ion battery technologies. Here, by using first-principles methods, we predict that the …

A combination of density functional theory (DFT) calculations and experiments is used to
shed light on the relation between surface structure and Li-ion storage capacities of the …

Two-dimensional (2-D) materials are capable of handling high rates of charge in batteries
since metal ions do not need to diffuse in a 3-D lattice structure. However, graphene, which …

Ga2O3 is attractive for power devices and solar-blind ultraviolet photodetectors due to its
ultra-wide bandgap, large breakdown field, and favorable stability. However, it is difficult to …

Density functional theory calculations are performed to unravel the nature of the contact
between metal electrodes and monolayer MoS2. Schottky barriers are shown to be present …