[HTML][HTML] CxNy-based materials as gas sensors: Structure, performance, mechanism and perspective
Carbon nitride (C x N y) materials, characterized by an ordered two-dimensional without
metal ions structure high N: C ratio, phase transition transformation, predispose them for …
metal ions structure high N: C ratio, phase transition transformation, predispose them for …
High-density cobalt single-atom catalysts for enhanced oxygen evolution reaction
P Kumar, K Kannimuthu, AS Zeraati… - Journal of the …, 2023 - ACS Publications
Single atom catalysts (SACs) possess unique catalytic properties due to low-coordination
and unsaturated active sites. However, the demonstrated performance of SACs is limited by …
and unsaturated active sites. However, the demonstrated performance of SACs is limited by …
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 …
Adsorption of gas molecules on intrinsic and defective MoSi2N4 monolayer: Gas sensing and functionalization
Z Cui, H Wu, K Yang, X Wang, Y Lv - Sensors and Actuators A: Physical, 2024 - Elsevier
The adsorption behaviors of CO, NH 3, NO, and NO 2 on intrinsic and defective MoSi 2 N 4
monolayer, and the electronic properties, magnetic and gas sensing properties are …
monolayer, and the electronic properties, magnetic and gas sensing properties are …
Puckered penta-like PdPX (X= O, S, Te) semiconducting nanosheets: first-principles study of the mechanical, electro-optical, and photocatalytic properties
The atomic, electronic, optical, and mechanical properties of penta-like two-dimensional
PdPX (X= O, S, Te) nanosheets have been systematically investigated using density …
PdPX (X= O, S, Te) nanosheets have been systematically investigated using density …
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 …
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 …
Electronic transport in biphenylene network monolayer: Proposals for 2D multifunctional carbon-based nanodevices
G Liu, T Chen, X Li, Z Xu, X Xiao - Applied Surface Science, 2022 - Elsevier
Very recently, the experimental synthesis of biphenylene network (BPN) monolayer has
achieve a great progress (Matetskiy et al., 2021). However, a systematic study of the …
achieve a great progress (Matetskiy et al., 2021). However, a systematic study of the …
C6N7 monolayer as an innovative sensor and scavenger for NO, H2S and SO2: A first-principles study
Z Wang, R Zhang, Z Liu, X Wei, M Zhao, X Zhang… - Surfaces and …, 2023 - Elsevier
The adsorption, electronic, gas-sensing and capture properties of molecules (NO, H 2 S, SO
2, NO 2, NH 3, N 2, CO, CH 4, CO 2, and H 2 O) on the C 6 N 7 monolayer were …
2, NO 2, NH 3, N 2, CO, CH 4, CO 2, and H 2 O) on the C 6 N 7 monolayer were …