Adsorption and Gas-Sensing Properties of Ag<sub>n</sub> (n = 1–4) Cluster Doped GeSe for CH<sub>4</sub> and CO Gases in Oil-Immersed Transformer

Adsorption and Gas-Sensing Properties of Ag<sub>n</sub> (n = 1–4) Cluster Doped GeSe for CH<sub>4</sub> and CO Gases in Oil-Immersed Transformer

The adsorption mechanism of CO and CH<sub>4</sub> on GeSe, modified with the most stable 1–4 Ag-atom clusters, is studied with the help of density functional theory. Adsorption distance, adsorption energy, total density of states (TDOS), projected density of states (PDOS), and molecular...

Full description

Bibliographic Details
Main Authors: Aijuan Dong, Meiling Sun, Yingang Gui
Format: Article
Language:English
Published: MDPI AG 2022-11-01
Series:Nanomaterials
Subjects:
Ag<sub>n</sub>-GeSe
adsorption
DFT
CH<sub>4</sub>
CO
Online Access:https://www.mdpi.com/2079-4991/12/23/4203

Internet

https://www.mdpi.com/2079-4991/12/23/4203

Similar Items