In the present work, the structural and optoelectronic properties of pristine and strained
hexagonal Hf 2 Br 2 N 2 monolayer have been investigated using the first-principles …

Abstract Adapting two-dimensional (2D) van der Walls bilayer heterostructure is an efficient
technique for realizing fascinating properties and playing a key role in solar energy-driven …

Herein, we systematically examine the electronic, optical and structural properties of two-
dimensional MoSe 2/PtS 2 van der Waals (vdW) heterostructures using the density …

We have investigated the electronic and finite temperature magnetic properties of
germanium carbide (GeC) and ferromagnetic chromium nitride (CrN) heterobilayers by …

Bidimensional nanostructures have been proposed as hydrogen-storage systems owing to
their large surface-to-volume ratios. Germanium carbide monolayers (GeC-MLs) can offer …

Constructing two-dimensional (2D) van der Waals (vdW) heterostructures is a promising
strategy to improve the photocatalytic efficiency of a single 2D material and has attracted …

Based on first-principles calculations, the stacking, electronic and optical properties of
GeC/β-AsP heterostructure have been explored. It is found that the GeC/β-AsP …

In recent years, several atomically thin two-dimensional (2D) materials have been reported
with remarkable properties that prospect them as potential structures for nanotechnological …

Nine kinds of non-metal atoms adsorbed into germanium carbide (NM-GeC) systems
wereare investigated by first-principles calculations. The results show that the most stable …

Based on first-principles calculations, variations in the stability as well as the electronic and
optical properties of fluorinated MoSi 2 N 4 (MoSi 2 N 4-F x, x= 0–16) were investigated …