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Vacancy-engineered half-metallicity and magnetic anisotropy in CrSI semiconductor monolayer
I Muhammad, A Ali, L Zhou, W Zhang… - Journal of Alloys and …, 2022 - Elsevier
By virtue of their complete spin polarization at the Fermi level, two-dimensional (2D)
magnetic half-metallic materials are emerging as one of the latest wonder building blocks for …
magnetic half-metallic materials are emerging as one of the latest wonder building blocks for …
Superior carrier tuning in ultrathin superconducting materials by electric-field gating
Abstract Two-dimensional (2D) superconductors with excellent crystallinity down to the
monolayer have many unusual properties absent in the three-dimensional (3D) bulk, such …
monolayer have many unusual properties absent in the three-dimensional (3D) bulk, such …
First principles predictions of Na and K storage in layered SnSe2
Recent years have witnessed a flow of research in two-dimensional (2D) materials for the
development of new rechargeable metal-ion battery systems due to their large surface areas …
development of new rechargeable metal-ion battery systems due to their large surface areas …
The elastic, electron, phonon, and vibrational properties of monolayer XO2 (X= Cr, Mo, W) from first principles calculations
W Fang, X ** novel two-dimensional (2D) materials and exploring their unique properties and
diverse potential applications are crucial areas of focus in materials science. Using density …
diverse potential applications are crucial areas of focus in materials science. Using density …
Tailoring the electronic and optical properties of ZrS2/ZrSe2 vdW heterostructure by strain engineering
JM Zhang, XY Gao, XM Wei, YH Huang, A Ali, I Shahid - Thin Solid Films, 2022 - Elsevier
Under framework of first-principles calculation, we construct ZrS 2/ZrSe 2 heterostructure
and explore the effects of the uniaxial and biaxial strains on its electronic and optical …
and explore the effects of the uniaxial and biaxial strains on its electronic and optical …
Monolayer XN2 (XTi, Zr, Hf): novel 2D materials with high stability, simultaneously high electron and hole mobilities from density functional theory
XF Sheng, S Chen, WB Kang, WY Fang - Materials Today Communications, 2022 - Elsevier
Abstract 2D nitrides have attracted extensive attention because of their novel photoelectric
properties and wide applications. In this work, we propose three novel 2D nitride materials …
properties and wide applications. In this work, we propose three novel 2D nitride materials …
Electrochemical Peeling Few-Layer SnSe2 for High-Performance Ultrafast Photonics
In recent years, the photoelectric properties and nonlinear optical properties of layered metal
chalcogenides (LMCs) have attracted extensive attentions. Because of lower phonon …
chalcogenides (LMCs) have attracted extensive attentions. Because of lower phonon …
Prediction of mechanical, electronic and optical properties of monolayer 1T Si-dichalcogenides via first-principles theory
This study utilizes first-principles calculations to predict the mechanical, electronic, and
optical properties of 1 T Si-dichalcogenides (SiX 2; X= S, Se, and Te). The results of dynamic …
optical properties of 1 T Si-dichalcogenides (SiX 2; X= S, Se, and Te). The results of dynamic …