The DOI matches its Crossref record; 7 of the 7 references it cites were found in a registry or an index.
Metal-Free Single Atom Catalyst for N2 Fixation Driven by Visible Light
Abstract
Solar nitrogen (N 2 ) fixation is the most attractive way for the sustainable production of ammonia (NH 3 ), but the development of a highly active, long-term stable and low-cost catalyst remains a great challenge. Current research efforts for N 2 reduction mainly focus on the metal-based catalysts using the electrochemical approach, while metal-free or solar-driven catalysts have been rarely explored. Herein, on the basis of a concept of electron “acceptance-donation”, a metal-free photocatalyst, namely, boron (B) atom, decorated on the optically active graphitic-carbon nitride (B/g-C 3 N 4 ), for the reduction of N 2 is proposed by using extensive first-principles calculations. Our results reveal that gas phase N 2 can be efficiently reduced into NH 3 on B/g-C 3 N 4 through the enzymatic mechanism with a record low onset potential (0.20 V). Moreover, the B-decorated g-C 3 N 4 can significantly enhance the visible light absorption, rendering them ideal for solar-driven reduction of N 2 . Importantly, the as-designed catalyst is further demonstrated to hold great promise for synthesis due to its extremely high stability. Our work is the first report of metal-free single atom photocatalyst for N 2 reduction, offering cost-effective opportunities for advancing sustainable NH 3 production.
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Cites
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
Kresse, G., & Furthmüller, J. (1996) · Physical Review B · doi:10.1103/physrevb.54.11169 · Cited by 123,652
Projector augmented-wave method
Blöchl, P. E. (1994) · Physical Review B · doi:10.1103/physrevb.50.17953 · Cited by 92,732
From ultrasoft pseudopotentials to the projector augmented-wave method
Kresse, G., & Joubert, D. (1999) · Physical Review B · doi:10.1103/physrevb.59.1758 · Cited by 85,307
Combining theory and experiment in electrocatalysis: Insights into materials design
Seh, Z. W., Kibsgaard, J., Dickens, C. F., Chorkendorff, I., Nørskov, J. K., & Jaramillo, T. F. (2017) · Science · doi:10.1126/science.aad4998 · Cited by 12,114
Metal-free efficient photocatalyst for stable visible water splitting via a two-electron pathway
Liu, J., Liu, Y., Liu, N., Han, Y., Zhang, X., Huang, H., Lifshitz, Y., Lee, S.-T., Zhong, J., & Kang, Z. (2015) · Science · doi:10.1126/science.aaa3145 · Cited by 4,468
Hydrogen evolution by a metal-free electrocatalyst
Zheng, Y., Jiao, Y., Zhu, Y., Li, L. H., Han, Y., Chen, Y., Du, A., Jaroniec, M., & Qiao, S. Z. (2014) · Nature Communications · doi:10.1038/ncomms4783 · Cited by 2,236
Self-citationYang, S., Feng, X., Wang, X., & Müllen, K. (2011) · Angewandte Chemie International Edition · doi:10.1002/anie.201100170 · Cited by 1,109
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Single-Atom Catalysts across the Periodic Table
Kaiser, S. K., Chen, Z., Faust Akl, D., Mitchell, S., & Pérez-Ramírez, J. (2020) · Chemical Reviews · doi:10.1021/acs.chemrev.0c00576 · Cited by 1,367
Highly Efficient and Selective Generation of Ammonia and Hydrogen on a Graphdiyne-Based Catalyst
Hui, L., Xue, Y., Yu, H., Liu, Y., Fang, Y., Xing, C., Huang, B., & Li, Y. (2019) · Journal of the American Chemical Society · doi:10.1021/jacs.9b03004 · Cited by 587
Recent Progress of Metal Sulfide Photocatalysts for Solar Energy Conversion
Zhu, Q., Xu, Q., Du, M., Zeng, X., Zhong, G., Qiu, B., & Zhang, J. (2022) · Advanced Materials · doi:10.1002/adma.202202929 · Cited by 423
Single-Atom (Iron-Based) Catalysts: Synthesis and Applications
Singh, B., Gawande, M. B., Kute, A. D., Varma, R. S., Fornasiero, P., McNeice, P., Jagadeesh, R. V., Beller, M., & Zbořil, R. (2021) · Chemical Reviews · doi:10.1021/acs.chemrev.1c00158 · Cited by 373
Lv, X., Wei, W., Huang, B., Dai, Y., & Frauenheim, T. (2021) · Nano Letters · doi:10.1021/acs.nanolett.0c05080 · Cited by 369
Metadata
- Authors
- Ling, C., Niu, X., Li, Q., Du, A., & Wang, J.
- Venue
- Journal of the American Chemical Society
- Publisher
- American Chemical Society (ACS)
- Published
- 2018-10-04
- Volume
- 140
- Issue
- 43
- Pages
- 14161-14168
- ISSN
- 0002-7863 (ISSN-L)
- 1520-5126
- OpenAlex
- W2895283837
- Cited by
- 977
- References
- 7
- FWCI
- 23.65
- Type
- journal article
- Language
- en
- Open access
- closed
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