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We have performed Density Functional Theory (DFT) based calculations to investigate the effects of stacking patterns on the electronic and magnetic properties of several Nitride MXenes. MXenes, a relatively new addition to the family of…

材料科学 · 物理学 2024-05-28 Himangshu Sekhar Sarmah , Subhradip Ghosh

The compressive and post-buckling behavior of Ti2C and Ti2CO2 MXene nanosheets is studied using large-scale reactive molecular dynamics simulations. Nanosheets are subjected to uniaxial, biaxial, and shear loads to investigate their…

材料科学 · 物理学 2025-12-08 Hossein Darban

MXenes are a new, and growing, family of 2D materials with very promising properties for a wide variety of applications. Obtained from the etching of MAX phases, numerous properties can be targeted thanks to the chemical richness of the…

Here, we report the first successful exfoliation of two-dimensional Ti$_3$C$_2$T$_x$ MXene through selective etching of silicon from titanium silicon carbide (Ti$_3$SiC$_2$) MAX. The successful etching and exfoliation of MXene is confirmed…

应用物理 · 物理学 2020-06-17 Qandeel Noor , Syedah Afsheen Zahra , Syed Rizwan

The properties of MXenes, a new group of quasi-two-dimensional d-metal carbide or nitride nanomaterials derived by chemical exfoliation from the MAX phases, can be very sensitive to the presence of surface functional groups. Herein, the…

材料科学 · 物理学 2013-04-10 Andrey N. Enyashin , Alexander L. Ivanovskii

Janus MXenes, a new category of two-dimensional (2D) materials, shows promising potential for advances in optoelectronics, spintronics and nanoelectronics. Our theoretical investigations not only provide interesting insights but also…

材料科学 · 物理学 2024-01-12 Swetarekha Ram , Namitha Anna Koshi , Seung-Cheol Lee , Satadeep Bhattacharjee

Vacancies play a pivotal role in determining the physical and chemical properties of materials. Introducing vacancies into two-dimensional (2D) materials offers a promising strategy for developing high-performance electrode materials for…

MXene, the two-dimensional derivatives of MAX compounds, due to their structural and compositional flexibility, is an ideal family of compounds to study a number of structure-property relations. In this work, we have investigated the…

材料科学 · 物理学 2024-02-28 Himangshu Sekhar Sarmah , Subhradip Ghosh

Currently, superconductivity in two-dimensional (2D) materials is a hot topic of research owing to their potential technological applications. Here, we report observation of superconductivity in a 2D Nb2C MXene with transition temperature…

Chiral helimagnets based on intercalated transition-metal dichalcogenides, characterized by nano-scale spin ordering, provide a powerful route to engineer chiral spin textures (e.g. the topologically protected magnetic solitons) and…

In this study, we investigate the effect of mixed surface terminations (F, O, OH) on the properties of M$_{2}$C MXenes (M = Sc, Ti, V). We explore how different compositions and patterns of terminal groups affect the stability and…

材料科学 · 物理学 2025-09-25 Michal Novotný , Karolína Tkáčová , František Karlický

Surface Engineering in two-dimensional(2D) materials has turned out to be an useful technique to improve their functional properties. By designing Janus compounds MM$^{\prime}$C in MXene family of compounds M$_{2}$C where the two surfaces…

材料科学 · 物理学 2023-10-11 Mandira Das , Subhradip Ghosh

Surface termination is known to play an important role in determining the physical properties of materials. It is crucial to know how surface termination affects the metal-insulator transition (MIT) of V$_2$O$_3$ films for both fundamental…

强关联电子 · 物理学 2021-06-17 Asish K. Kundu , Sukanta Barman , Krishnakumar S. R. Menon

Hybrid materials of MXenes (2D carbides and nitrides) and transition-metal oxides (TMOs) have shown great promise in electrical energy storage and 2D heterostructures have been proposed as the next-generation electrode materials to expand…

材料科学 · 物理学 2021-07-21 Lihua Xu , Tao Wu , Paul R. C. Kent , De-en Jiang

The rapid advancement of nanomaterials has paved the way for various technological breakthroughs, and MXenes, in particular, have gained substantial attention due to their unique properties such as high conductivity, broad-spectrum…

Manganese-based MXenes are promising two-dimensional materials due to the broad palette of their magnetic phases and the possibility of experimental preparation because the corresponding MAX phase was already prepared. Here, we…

材料科学 · 物理学 2024-08-01 Jiří Kalmár , František Karlický

A potential application of two-dimensional (2D) MXenes, such as Ti2CTx and Ti3C2Tx, is energy storage devices, such as supercapacitors, batteries, and hydride electrochemical cells, where intercalation of ions between the 2D layers is…

材料科学 · 物理学 2023-06-13 Lars-Åke Näslund , Martin Magnuson

Despite ample evidence of their influences on the transport properties of two-dimensional solids, the interrelations of reduced symmetry, electronic and thermal transport, have rarely being discussed in the context of thermoelectric…

材料科学 · 物理学 2024-01-15 Himangshu Murari , Subhradip Ghosh

The surface terminations of 122-type alkaline earth metal iron pnictides AEFe2As2 (AE = Ca, Ba) are investigated with scanning tunneling microscopy/spectroscopy (STM/STS). Cleaving these crystals at a cryogenic temperature yields a large…

A chemical etching method was developed for (110) and (001) NdGaO3 single crystal substrates in order to obtain an atomically flat GaO2-x - terminated surface. Depending on the surface step density the substrates were etched in…

材料科学 · 物理学 2012-02-29 V. Leca , D. H. A. Blank , G. Rijnders