Recent advances in MXenes: beyond Ti-only systems

S Venkateshalu, M Shariq, B Kim, M Patel… - Journal of Materials …, 2023 - pubs.rsc.org
Since the first report on Ti3C2Tx in 2011, the number of reports on 2D transition metal
carbides and nitrides, known as MXenes, has increased rapidly. Most of the reports have …

2D non-carbide MXenes: an emerging material class for energy storage and conversion

S Venkateshalu, M Shariq, NK Chaudhari… - Journal of Materials …, 2022 - pubs.rsc.org
Since the first discovery of MXenes in 2011, various compositions of MXenes have been
developed based on the combinations of different transition metals. Their exceptional and …

Theoretical investigations of O-and F-surface functionalization of MXenes based on Cr2M (M= C, N)

BU Haq, SH Kim, SA Tahir, R Ahmed, S AlFaify… - Materials Science in …, 2023 - Elsevier
This study reports the effect of O-and F-based functional groups on the properties of Cr 2 M
(M= C, N) based MXenes that have emerged as promising two-dimensional (2D) materials …

Rational Design of Stimuli‐Responsive Inorganic 2D Materials via Molecular Engineering: Toward Molecule‐Programmable Nanoelectronics

J Muñoz - Advanced Materials, 2024 - Wiley Online Library
The ability of electronic devices to act as switches makes digital information processing
possible. Succeeding graphene, emerging inorganic 2D materials (i2DMs) have been …

Potential of MXenes as a novel material for spintronic devices: a review

T Amrillah, A Hermawan, YB Cristian… - Physical Chemistry …, 2023 - pubs.rsc.org
The search for materials for next-generation spintronic applications has witnessed
exponentially increasing interest, mainly due to the explosive development of numerous two …

Prediction of electronic structure and magnetic anisotropy of two-dimensional MSi2N4 (M= 3d transition-metal) monolayers

Z Zhao, X Duan, X Fang, X Wang, W Mi - Applied Surface Science, 2023 - Elsevier
Abstract Two-dimensional (2D) transition metal nitrides have potential applications in novel
low-dimensional spintronic devices due to their unique properties such as higher surface …

The nature of the electronic ground state of M 2 C (M= Ti, V, Cr, Zr, Nb, Mo, Hf, Ta, and W) MXenes

N García-Romeral, Á Morales-García, F Viñes… - Physical Chemistry …, 2023 - pubs.rsc.org
A systematic computational study is presented aimed at accurately describing the electronic
ground state nature and properties of M2C (M= Ti, V, Cr, Zr, Nb, Mo, Hf, Ta, and W) MXenes …

Ferromagnetic vanadium disulfide VS 2 monolayers with high Curie temperature and high spin polarization

HJ Wu, YL Wan, ZY Zeng, CE Hu, XR Chen… - Physical Chemistry …, 2023 - pubs.rsc.org
The structural, electronic, and magnetic properties of vanadium disulfide VS2 monolayers
were investigated using first-principles calculations and Monte Carlo (MC) simulations. The …

Theoretical Analysis of Magnetic Coupling in the Ti2C Bare MXene

N García-Romeral, Á Morales-García… - The Journal of …, 2023 - ACS Publications
The nature of the electronic ground state of the Ti2C MXene is unambiguously determined
by making use of density functional theory-based calculations including hybrid functionals …

Strain Effects on the Two-Dimensional Cr2N MXene: An Ab Initio Study

SJ Gutiérrez-Ojeda, R Ponce-Pérez… - ACS …, 2022 - ACS Publications
Structural, electronic, and magnetic properties of two-dimensional Cr2N MXene under strain
were studied. The uniaxial and biaxial strain was considered from− 5 to 5%. Phonon …