Density Functional Theory Investigation of Temperature-Dependent Properties of Cu-Nitrogen-Doped Graphene as a Cathode Material in Fuel Cell Applications

Density Functional Theory Investigation of Temperature-Dependent Properties of Cu-Nitrogen-Doped Graphene as a Cathode Material in Fuel Cell Applications

In this study, density functional theory (DFT) was used to investigate the influence of temperature on the performance of a novel Cu-nitrogen-doped graphene Cu<sub>2</sub>-N<sub>8</sub>/Gr nanocomposite as a catalyst for the oxygen reduction reaction (ORR) in fuel cell applic...

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Bibliographic Details
Main Authors: Yashas Balasooriya, Pubudu Samarasekara, Chee Ming Lim, Yuan-Fong Chou Chau, Muhammad Raziq Rahimi Kooh, Roshan Thotagamuge
Format: Article
Language:English
Published: MDPI AG 2023-11-01
Series:Molecules
Subjects:
DFT
fuel cell
oxygen reduction reaction
temperature effect on fuel cell
H<sub>2</sub>O<sub>2</sub> generation
copper–nitrogen-doped graphene
Online Access:https://www.mdpi.com/1420-3049/28/23/7873

Internet

https://www.mdpi.com/1420-3049/28/23/7873

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