Electronic “bridge” construction via Ag intercalation to diminish catalytic anisotropy for 2D tin diselenide cathode catalyst in lithium–oxygen batteries

G Zhang, C Liu, L Guo, R Liu, L Miao… - Advanced Energy …, 2022 - Wiley Online Library
As cathode catalysts for lithium–oxygen batteries (LOBs), 2D materials are attracting
significant attention due to their layered structures, tunable surface chemistry, and unique …

Photocatalytic hydrogen evolution reaction with high solar-to-hydrogen efficiency driven by the Sb2S3 monolayer and RuI2/Sb2S3 heterostructure with solar light

F Wang, CL Yang, MS Wang, X Ma - Journal of Power Sources, 2022 - Elsevier
The feasibility and solar-to-hydrogen efficiency (η STH) of the photocatalytic hydrogen
evolution reaction (HER) with the Sb 2 S 3–P2 1/m monolayer and RuI 2/Sb 2 S 3–P3m 1 …

Magneto-optical transport properties of monolayer transition metal dichalcogenides

ND Hien, CV Nguyen, NN Hieu, SS Kubakaddi… - Physical Review B, 2020 - APS
We study the optical transport properties of the monolayer transition metal dichalcogenides
(TMDCs) such as MoS 2, WS 2, MoSe 2, and WSe 2 in the presence of a magnetic field. The …

Ab initio prediction of semiconductivity in a novel two-dimensional Sb2X3 (X= S, Se, Te) monolayers with orthorhombic structure

A Bafekry, B Mortazavi, M Faraji, M Shahrokhi… - Scientific Reports, 2021 - nature.com
Abstract Sb 2 S 3 and Sb 2 Se 3 are well-known layered bulk structures with weak van der
Waals interactions. In this work we explore the atomic lattice, dynamical stability, electronic …

Two-dimensional ZnI2 monolayer as a photocatalyst for water splitting and improvement its electronic and optical properties by strains

AOM Almayyali, HO Muhsen, M Merdan… - Physica E: Low …, 2021 - Elsevier
We investigate the electronic and optical properties of zinc iodide (ZnI 2) under the effect of
the biaxial strains. It has been emphasized that ZnI 2 monolayer is stable based on the …

Stacking impact on the optical and electronic properties of two-dimensional MoSe2/PtS2 heterostructures formed by PtS2 and MoSe2 monolayers

AOM Almayyali, BB Kadhim, HR Jappor - Chemical Physics, 2020 - Elsevier
Herein, we systematically examine the electronic, optical and structural properties of two-
dimensional MoSe 2/PtS 2 van der Waals (vdW) heterostructures using the density …

Electronic, optical and thermoelectric properties of a novel two-dimensional SbXY (X= Se, Te; Y= Br, I) family: ab initio perspective

A Bafekry, M Faraji, MM Fadlallah, DM Hoat… - Physical Chemistry …, 2021 - pubs.rsc.org
Recent developments in the synthesis of highly crystalline ultrathin BiTeX (X= Br, Cl)
structures [Debarati Hajra et al., ACS Nano 14, 15626 (2020)] have led to the exploration of …

Two-dimensional carbon allotropes with tunable direct band gaps and high carrier mobility

W Zhang, C Chai, Q Fan, Y Song, Y Yang - Applied Surface Science, 2021 - Elsevier
Using first-principles calculations, two sp 2+ sp 3-hybridized two-dimensional (2D) carbon
allotropes with stable orthorhombic structures are predicted in this work. Both structures are …

Semiconducting chalcogenide alloys based on the (Ge, Sn, Pb)(S, Se, Te) formula with outstanding properties: a first-principles calculation study

A Bafekry, M Shahrokhi, A Shafique, HR Jappor… - ACS …, 2021 - ACS Publications
Very recently, a new class of the multicationic and-anionic entropy-stabilized chalcogenide
alloys based on the (Ge, Sn, Pb)(S, Se, Te) formula has been successfully fabricated and …

Tunable electronic and optical properties of new two-dimensional GaN/BAs van der Waals heterostructures with the potential for photovoltaic applications

AA Attia, HR Jappor - Chemical Physics Letters, 2019 - Elsevier
First-principle calculations have been executed to examine the optical and electronic
properties of two-dimensional GaN/BAs heterostructures with three possible stacking orders …