External uniaxial compressive strain induced built-in electric field in bilayer two-dimensional As2S3 for photocatalytic water splitting: A first-principles study

2021 ◽  
Vol 535 ◽  
pp. 147701 ◽  
Author(s):  
Xuefei Liu ◽  
Bing Lv ◽  
Zhao Ding ◽  
Zijiang Luo
Keyword(s):  
Electric Field ◽  
Water Splitting ◽  
First Principles ◽  
Compressive Strain ◽  
Two Dimensional ◽  
Photocatalytic Water Splitting ◽  
First Principles Study

scholarly journals Two-dimensional penta-Sn3H2 monolayer for nanoelectronics and photocatalytic water splitting: a first-principles study

RSC Advances ◽  
2018 ◽  
Vol 8 (21) ◽  
pp. 11799-11806 ◽  
Author(s):  
Peng Zhang ◽  
Xibin Yang ◽  
Wei Wu ◽  
Lifen Tian ◽  
Daxi Xiong ◽  
...  
Keyword(s):  
Water Splitting ◽  
First Principles ◽  
Two Dimensional ◽  
Photocatalytic Water Splitting ◽  
First Principles Study ◽  
Two Dimensional Materials ◽  
Potential Applications

Exploring two-dimensional materials with novel properties is becoming particularly important due to their potential applications in future electronics and optoelectronics.

Two-dimensional multilayer M2CO2(M = Sc, Zr, Hf) as photocatalysts for hydrogen production from water splitting: a first principles study

2017 ◽  
Vol 5 (47) ◽  
pp. 24972-24980 ◽  
Author(s):  
Cen-Feng Fu ◽  
Xingxing Li ◽  
Qiquan Luo ◽  
Jinlong Yang
Keyword(s):  
Hydrogen Production ◽  
Water Splitting ◽  
First Principles ◽  
Theoretical Study ◽  
Two Dimensional ◽  
First Principles Study

Theoretical study on two-dimensional multilayered MXenes for hydrogen production from water splitting.

Transition-metal dichalcogenides/Mg(OH)2 van der Waals heterostructures as promising water-splitting photocatalysts: a first-principles study

2019 ◽  
Vol 21 (4) ◽  
pp. 1791-1796 ◽  
Author(s):  
Yi Luo ◽  
Sake Wang ◽  
Kai Ren ◽  
Jyh-Pin Chou ◽  
Jin Yu ◽  
...  
Keyword(s):  
Transition Metal ◽  
Water Splitting ◽  
First Principles ◽  
Van Der Waals ◽  
Transition Metal Dichalcogenides ◽  
Van Der Waals Heterostructures ◽  
Photocatalytic Water Splitting ◽  
First Principles Study ◽  
Metal Dichalcogenides

We found that the MoS2/Mg(OH)2 and WS2/Mg(OH)2 vdW heterostructures are promising for application in photocatalytic water splitting.

scholarly journals Two-dimensional silicon bismotide (SiBi) monolayer with a honeycomb-like lattice: first-principles study of tuning the electronic properties

RSC Advances ◽  
2020 ◽  
Vol 10 (53) ◽  
pp. 31894-31900 ◽  
Author(s):  
Asadollah Bafekry ◽  
Fazel Shojaei ◽  
Mohammed M. Obeid ◽  
Mitra Ghergherehchi ◽  
C. Nguyen ◽  
...  
Keyword(s):  
Electric Field ◽  
Electronic Properties ◽  
Layer Thickness ◽  
First Principles ◽  
Mechanical Strain ◽  
Dft Method ◽  
Two Dimensional ◽  
First Principles Study

The modulation of the electronic properties of SiBi monolayer via external means, including layer thickness, electric field and mechanical strain are explored with DFT method.

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