Computational design of single-atom catalysts embedded on reduced graphitic carbon nitride monolayers
The design of efficient single-atom catalysts (SACs) with optimal activity and selectivity for sustainable energy and environmental applications remains a challenge. In this work, comprehensive first-principles calculations are performed to validate the feasibility of single TM atoms ( 3d , 4d , and...
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| Principais autores: | , , , |
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| 格式: | Artigo |
| 語言: | Inglês |
| 出版: |
IOP Publishing
2024-01-01
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| 叢編: | Nano Express |
| 主題: | |
| 在線閱讀: | https://doi.org/10.1088/2632-959X/ad34a6 |
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