First-principles study on GeC/β-AsP heterostructure with type-II band alignment for photocatalytic water splitting

Y Mao, C Qin, X Zhou, Z Zhang, J Yuan - Applied Surface Science, 2023 - Elsevier
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 …

Versatile van der Waals heterostructures of γ-GeSe with h-BN/graphene/MoS 2

C Huan, P Wang, B Liu, B He, Y Cai… - Journal of Materials …, 2022 - pubs.rsc.org
The recent discovery of a novel hexagonal phase of GeSe (γ-GeSe) has triggered great
interest in nanoelectronics applications owing to the electrical conductivity of its bulk phase …

Highly efficient photocatalytic water splitting in direct Z-scheme α-In2Se3/Are van der Waals heterostructures

Q Lu, LL Zhang, TT Xu, BY Zhang, WJ Gong - Surfaces and Interfaces, 2023 - Elsevier
It has been shown that adopting two-dimensional (2D) semiconductors as photocatalyst for
water splitting can be a promising way to achieve green and clean energy. We investigate …

Quantum transport of sub-5 nm InSe and In 2 SSe monolayers and their heterostructure transistors

H Guo, Y Yin, W Yu, J Robertson, S Liu, Z Zhang… - Nanoscale, 2023 - pubs.rsc.org
The emerging two-dimensional (2D) semiconductors hold a promising prospect for
sustaining Moore's law benefitting from the excellent device electrostatics with narrowed …

Ideal electrodes for monolayer boron phosphide and their device performance

H Li, J Li, Y Liu, K An, F Liu, J Lu - Applied Surface Science, 2024 - Elsevier
Pursuing low contact resistance is crucial for ameliorating performances of short-channel
Schottky barrier field effect transistors (SBFETs). We have studied the electrical contact …

Type‐II van der Waals heterostructures based on AsP and transition metal dichalcogenides: great promise for applications in solar cell

H Zhao, L Han, B Jia, Y Chen, X Guan… - physica status solidi …, 2022 - Wiley Online Library
As an effective means to adjust the properties of 2D materials, type‐II van der Waals (vdW)
heterostructures have been under extensive research due to their significantly reduced …

Tunability in electronic and optical properties of GaS/PbS vdW heterostructure

K Kumar, M Sharma, R Pandey - Journal of Physics and Chemistry of …, 2025 - Elsevier
A promising novel class of heterostructures has recently emerged, combining a
semiconducting GaS monolayer with other 2D materials for energy-related applications. In …

Unveiling Versatile Electronic Properties and Contact Features of Metal–Semiconductor Graphene/γ-Ge2SSe van der Waals Heterostructures

TV Vu, AI Kartamyshev, TH Ho, NN Hieu, HV Phuc… - Langmuir, 2024 - ACS Publications
Recently, searching for a metal–semiconductor junction (MSJ) that exhibits low-contact
resistance has received tremendous consideration, as they are essential components in …

First-principles prediction of the electronic properties and contact features of graphene/γ-GeSe van der Waals heterostructure: effects of electric fields and strains

TV Vu, AI Kartamyshev, AA Lavrentyev, NN Hieu… - RSC …, 2024 - pubs.rsc.org
In this work, we investigate systematically the electronic properties and tunable contact
behavior of the graphene/γ-GeSe heterostructure under applied electric fields and out-of …

Screening ideal MXene electrodes for monolayer MoSe2: A first-principles study

W Yu, H Li, M Zhao, X Chen, K An, F Liu, J Lu - Materials Today …, 2024 - Elsevier
Exploring proper electrodes with low-resistance contacts is vital for promoting the
performance of nanoelectronics. We have screened 35 kinds of metallic monolayer (ML) …