Novel Insights into Surface Energies and Enhanced Gas-Sensing Capabilities of ZnGa<sub>2</sub>O<sub>4</sub>(111) via Ab Initio Studies

Novel Insights into Surface Energies and Enhanced Gas-Sensing Capabilities of ZnGa<sub>2</sub>O<sub>4</sub>(111) via Ab Initio Studies

This study investigates the surface energies and work function changes in ZnGa<sub>2</sub>O<sub>4</sub>(111) surfaces with different atomic terminations using ab initio density functional theory. It explores the interactions of gas molecules such as NO, NO<sub>2</sub...

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Bibliographic Details
Main Authors: Cheng-Lung Yu, Yan-Cheng Lin, Sheng-Yuan Jhang, Jine-Du Fu, Yi-Chen Chen, Po-Liang Liu
Format: Article
Language:English
Published: MDPI AG 2025-01-01
Series:Sensors
Subjects:
Ab initio study
ZnGa<sub>2</sub>O<sub>4</sub>
work function change
gas sensor
Online Access:https://www.mdpi.com/1424-8220/25/2/548
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