The DOI matches its Crossref record; 1 of the 1 references it cites were found in a registry or an index.
Conversion of Dinitrogen to Ammonia by FeN3-Embedded Graphene
Abstract
Nitrogen fixation is one of the most important issues but a long-standing challenge in chemistry. Here, we propose FeN3-embedded graphene as the catalyst for nitrogen fixation from first-principles calculations. Results show that in view of the chemical coordination, the FeN3 center is highly spin-polarized with a localized magnetic moment substantially to promote N2 adsorption and activate its inert N-N triple bond. The synergy between the graphene and FeN3 equips the system with novel features for the catalytic conversion of the activated N2 into NH3 via a six-proton and six-electron process, following three possible reaction pathways at room temperature. Our findings provide a rational paradigm for catalytic nitrogen fixation that would be conducive to ammonia production.
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Citations
Cites
The Evolution and Future of Earth’s Nitrogen Cycle
Canfield, D. E., Glazer, A. N., & Falkowski, P. G. (2010) · Science · doi:10.1126/science.1186120 · Cited by 2,697
Cited by
Fei, H., Dong, J., Feng, Y., Allen, C. S., Wan, C., Volosskiy, B., Li, M., Zhao, Z., Wang, Y., Sun, H., et al. (2018) · Nature Catalysis · doi:10.1038/s41929-017-0008-y · Cited by 1,973
A Review of Electrocatalytic Reduction of Dinitrogen to Ammonia under Ambient Conditions
Cui, X., Tang, C., & Zhang, Q. (2018) · Advanced Energy Materials · doi:10.1002/aenm.201800369 · Cited by 1,314
Zhao, J., & Chen, Z. (2017) · Journal of the American Chemical Society · doi:10.1021/jacs.7b05213 · Cited by 1,249
A review of ammonia as a compression ignition engine fuel
Dimitriou, P., & Javaid, R. (2020) · International Journal of Hydrogen Energy · doi:10.1016/j.ijhydene.2019.12.209 · Cited by 991
Heterogeneous Fe3 single-cluster catalyst for ammonia synthesis via an associative mechanism
Liu, J.-C., Ma, X.-L., Li, Y., Wang, Y.-G., Xiao, H., & Li, J. (2018) · Nature Communications · doi:10.1038/s41467-018-03795-8 · Cited by 676
Metadata
- Authors
- Li, X.-F., Li, Q.-K., Cheng, J., Liu, L., Yan, Q., Wu, Y., Zhang, X.-H., Wang, Z.-Y., Qiu, Q., & Luo, Y.
- Venue
- Journal of the American Chemical Society
- Publisher
- American Chemical Society (ACS)
- Published
- 2016-07-11
- Volume
- 138
- Issue
- 28
- Pages
- 8706-8709
- ISSN
- 0002-7863 (ISSN-L)
- 1520-5126
- OpenAlex
- W2460396937
- Cited by
- 691
- References
- 1
- FWCI
- 15.68
- Type
- journal article
- Language
- en
- Open access
- closed
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Contains information from the Semantic Scholar Academic Graph Datasets, made available under the ODC Attribution License (ODC-BY 1.0).
Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.
