On using non-Kekulé triangular graphene quantum dots for scavenging hazardous sulfur hexafluoride components

On using non-Kekulé triangular graphene quantum dots for scavenging hazardous sulfur hexafluoride components

The goal of present study is to explore how the size and functionalization of graphene quantum dots (GQDs) affect their sensing capabilities. Specifically, we investigated the adsorption of SO2, SOF2, SO2F2, and SF6 on GQDs that were functionalized with –CH3, –COCH3, and –NH2. We used density functi...

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Bibliographic Details
Main Authors: Vaishali Roondhe, Basant Roondhe, Sumit Saxena, Rajeev Ahuja, Alok Shukla
Format: Article
Language:English
Published: Elsevier 2023-04-01
Series:Heliyon
Subjects:
Graphene quantum dot
Sulfur hexafluoride
Density functional theory
Chemical functionalization
Electronic properties
Online Access:http://www.sciencedirect.com/science/article/pii/S2405844023025951

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