Understanding the activity of carbon-based single-atom electrocatalysts from ab initio simulations
Heterogeneous single-atom catalysis has attracted great research interest in recent years. The atomically dispersed metal atoms, which are generally active sites in single-atom catalysts, could result in unconventional reaction mechanisms due to the site confinement of reaction intermediates. Their...
Main Authors: | Zhong, Lixiang, Zhang, Liming, Li, Shuzhou |
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Other Authors: | School of Materials Science and Engineering |
Format: | Journal Article |
Language: | English |
Published: |
2023
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Subjects: | |
Online Access: | https://hdl.handle.net/10356/165082 |
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