Coverage-dependent adsorption of small gas molecules on black phosphorene: a DFT study

2021 ◽  
pp. 121860
Author(s):  
Anass Sibari ◽  
Zineb Kerrami ◽  
Mohammed Benaissa ◽  
Abdelkader Kara
Keyword(s):  
Dft Study ◽  
Black Phosphorene ◽  
Gas Molecules

A DFT Study of the Adhesion of Pd Clusters on ZnO SWNTs and Adsorption of Gas Molecules on Pd/ZnO SWNTs

2009 ◽  
Vol 113 (51) ◽  
pp. 21338-21341 ◽  
Author(s):  
Yan Su ◽  
Qiang-qiang Meng ◽  
Jian-guo Wang
Keyword(s):  
Dft Study ◽  
Gas Molecules ◽  
Pd Clusters

scholarly journals Adsorption behavior of 2, 3, 7, 8-tetrachlorodibenzo-p-dioxin on pristine and doped black phosphorene: A DFT study

Chemosphere ◽  
2017 ◽  
Vol 185 ◽  
pp. 509-517 ◽  
Author(s):  
Hong-ping Zhang ◽  
Jia-liang Hou ◽  
Yaobin Wang ◽  
Ping-ping Tang ◽  
Ya-ping Zhang ◽  
...  
Keyword(s):  
Adsorption Behavior ◽  
Dft Study ◽  
Black Phosphorene ◽  
Tetrachlorodibenzo P Dioxin

Adsorption for SO2 gas molecules on B, N, P and Al doped MoS2: The DFT study

2019 ◽  
Vol 715 ◽  
pp. 273-277 ◽  
Author(s):  
Ruiyang Zhang ◽  
Da Fu ◽  
Jiaming Ni ◽  
Chunbao Sun ◽  
Shaoxian Song
Keyword(s):  
Dft Study ◽  
Gas Molecules ◽  
So2 Gas

Pt-decorated Phosphorene as a Propitious Room Temperature VOCs Gas Sensor for Sensitive and Selective Detection of Alcohols

2021 ◽  
Author(s):  
Aref Aasi ◽  
Sadegh Mehdi Aghaei ◽  
Balaji Panchapakesan
Keyword(s):  
Volatile Organic Compounds ◽  
Gas Sensor ◽  
Organic Compounds ◽  
Gas Sensors ◽  
Room Temperature ◽  
Selective Detection ◽  
Two Dimensional ◽  
Black Phosphorene ◽  
Volatile Organic ◽  
Gas Molecules

Inspired by prior advancements and the growing utilization of two-dimensional (2D) based gas sensors, this work presents the potential of black phosphorene for sensing volatile organic compounds (VOCs) gas molecules....

RETRACTED: Adsorption of gas molecules on the defective stanene nanosheets with single vacancy: A DFT study

2020 ◽  
Vol 512 ◽  
pp. 145727 ◽  
Author(s):  
Yu Yang ◽  
Hao Zhang ◽  
Lihong Song ◽  
Zhenling Liu
Keyword(s):  
Dft Study ◽  
Single Vacancy ◽  
Gas Molecules

DFT study of small gas molecules adsorbed on undoped and N-, Si-, B-, and Al-doped graphene quantum dots

2019 ◽  
Vol 138 (3) ◽  
Author(s):  
F. Montejo-Alvaro ◽  
J. Oliva ◽  
M. Herrera-Trejo ◽  
H. M. Hdz-García ◽  
A. I. Mtz-Enriquez
Keyword(s):  
Quantum Dots ◽  
Graphene Quantum Dots ◽  
Dft Study ◽  
Doped Graphene ◽  
Gas Molecules
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