High hydrogen production in two-dimensional GaTe/ZnI2 type-II heterostructure for water splitting
In this work, first-principles calculation was used to systematically examine the structural,
electronic, and optical properties of the GaTe/ZnI 2 heterostructure under the biaxial strain …
electronic, and optical properties of the GaTe/ZnI 2 heterostructure under the biaxial strain …
Prediction of two-dimensional AlBrSe monolayer as a highly efficient photocatalytic for water splitting
S Tareq, AOM Almayyali, HR Jappor - Surfaces and Interfaces, 2022 - Elsevier
The effect of biaxial strain on the electronic and optical properties of orthorhombic two-
dimensional AlBrSe monolayer was investigated by the first-principles calculations. Stability …
dimensional AlBrSe monolayer was investigated by the first-principles calculations. Stability …
Two-dimensional XY monolayers (X= Al, Ga, In; Y= N, P, As) with a double layer hexagonal structure: A first-principles perspective
In this paper, we systematically investigate the structural, mechanical, optical and electronic
properties of novel two-dimensional XY (X= Al, Ga, In; Y= N, P, As) monolayers in the double …
properties of novel two-dimensional XY (X= Al, Ga, In; Y= N, P, As) monolayers in the double …
PbBi2Se4 monolayer: a new 2D material with outstanding electronic, photocatalytic, and optical properties
AOM Almayyali, HR Jappor - Solid State Sciences, 2024 - Elsevier
Abstract Two-dimensional layered PbBi 2 Se 4 nanosheets were recently successfully
produced [Chatterjee et al., Phys. Chem. Chem. Phys., 2014, 16, 14,635–14639]. Inspired by …
produced [Chatterjee et al., Phys. Chem. Chem. Phys., 2014, 16, 14,635–14639]. Inspired by …
Nonvolatile Electrical Control and Reversible Gas Capture by Ferroelectric Polarization Switching in 2D FeI2/In2S3 van der Waals Heterostructures
G Liu, T Chen, G Zhou, Z Xu, X **ao - ACS sensors, 2023 - ACS Publications
Nonvolatile electrical control is the core of future magnetoelectric nanodevices. In this work,
we systematically explore both the electronic structures and transport properties of …
we systematically explore both the electronic structures and transport properties of …
Ab-initio-driven prediction of puckered penta-like PdPSeX (XO, S, Te) Janus monolayers: Study on the electronic, optical, mechanical and photocatalytic properties
A systematic investigation of the structural, mechanical, electronic, and optical properties of
puckered penta-like PdPSeX (X double bond O, S and Te) Janus monolayers has been …
puckered penta-like PdPSeX (X double bond O, S and Te) Janus monolayers has been …
Ultrafast all-optical quantum control of magnetization dynamics
With the development of laser and magneto-optical technology and the discovery of a broad
range of magnetic quantum materials exhibiting exotic properties and new physics, ultrafast …
range of magnetic quantum materials exhibiting exotic properties and new physics, ultrafast …
Unravelling the thermoelectric properties and suppression of bipolar effect under strain engineering for the asymmetric Janus SnSSe and PbSSe monolayers
Inspired by the groundbreaking discovery of the two-dimensional (2D) MoSSe materials, the
electronic, thermal, and thermoelectric properties of asymmetric Janus SnSSe and PbSSe …
electronic, thermal, and thermoelectric properties of asymmetric Janus SnSSe and PbSSe …
Metal to semiconductor switching in the AgTe monolayer via decoration with alkali metal and alkaline earth metal atoms: a first-principles perspective
In this work, employing first-principles calculations, we systematically investigate the atomic
structure and electronic and optical properties of the AgTe monolayer, as well as the impact …
structure and electronic and optical properties of the AgTe monolayer, as well as the impact …
Gas Sensing Properties of Pd-Decorated GeSe Monolayer toward Formaldehyde and Benzene Molecules: A First-Principles Study
G Guo, J Min, Y Xu, Y Zhou, G Xu - Langmuir, 2023 - ACS Publications
In this study, the gas sensing properties of formaldehyde (HCHO) and benzene (C6H6)
adsorbed on two-dimensional (2D) pristine GeSe and Pd-decorated GeSe (Pd–GeSe) …
adsorbed on two-dimensional (2D) pristine GeSe and Pd-decorated GeSe (Pd–GeSe) …