Using first-principles calculations, we investigate mechanical, electronic and optical
properties of so-called Janus structure for monolayer transition metal dichalcogenides …

In this work, we extensively investigate the structural and electronic properties of van der
Waals heterostructures (HTs) constructed by MoS 2/BC 3, MoS 2/C 3 N, MoS 2/$ C_ {3} N …

Chemical vapor deposition (CVD) allows lateral edge epitaxy of transition metal
dichalcogenide heterostructures. Critical for carrier and exciton transport is the material …

The emergence of two-dimensional semiconductors opens up new avenues for efficient,
ultrathin, and high-quality heterojunction solar cells. Herein, based on first-principles …

In this work, for the first time, the comparative electronic properties of homogenous and van
der Waals (vdW) heterostructure bilayers of Molybdenum Dichalcogenides, MoX 2 (X= S …

The strain-sensitive heterostructure, as a type of low-dimensional technique, has attracted
extensive attention, but the influence mechanism of the biaxial strain on its thermoelectric …

Abstract Two-dimensional (2D) transition metal dichalcogenides (TMDs) based van der
Waals (vdW) heterostructures are of technological importance in optical and electrical …

The structural stability, electronic properties, band edge alignment and photocatalytic water
splitting characteristics of the CdO/MoS 2 heterostructure have been systematically …

Thermoelectric materials have attracted much attention due to their crucial role in heat
conversion and cooling applications. Transport properties effectively conduct …

Understanding pressure-regulated electronic properties is crucial for integrating two-
dimensional semiconductors into flexible electronic devices and pressure sensors. We …