Graphene-Supported Single-Atom Catalysts for Sustainable Organic Conversions: Coordination Engineering, Selectivity, and Atom-Efficient Catalysis
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Graphene-Supported Single-Atom Catalysts for Sustainable Organic Conversions: Coordination Engineering, Selectivity, and Atom-Efficient CatalysisAbstract
Graphene-supported single-atom catalysts (G-SACs) combine the maximized metal utilization of isolated atoms with the recoverability, conductivity and structural tunability of a heterogeneous carbon support. They are therefore attractive for sustainable organic synthesis, where precious-metal economy, chemoselectivity and product purification are major concerns. This review examines the design, synthesis, characterization and catalytic application of isolated transition-metal atoms stabilized on graphene, graphene oxide and heteroatom-doped graphene. Particular attention is given to M-Nx-C coordination environments, vacancy defects, support-induced electronic effects and the distinction between stable single atoms and dynamically generated clusters. Organic transformations discussed include selective hydrogenation, oxidation, C-C and C-heteroatom bond formation, carbon dioxide incorporation and emerging bimetallic single-atom catalysis. Graphene-supported Pd single atoms illustrate how isolated sites can suppress ensemble-dependent over-hydrogenation, while Cu, Ni and Au single atoms demonstrate the ability of vacancy and nitrogen coordination to tune redox chemistry. A 2026 Pd1Au1/graphene bimetallic single-atom system has further shown that neighboring unlike single atoms can unlock C-C coupling pathways that are inactive on the corresponding monometallic SACs, highlighting the next stage of atomic-site engineering. Challenges include low or uncertain site density, agglomeration under reaction conditions, energy-intensive support preparation, limited substrate-scope data and inconsistent reporting of metal-normalized productivity. Future progress requires operando spectroscopy, scalable defect engineering, structured graphene supports, explicit leaching tests, critical-metal recovery and process-level green metrics. G-SACs offer a powerful bridge between homogeneous and heterogeneous catalysis when the atomic structure of the active site is demonstrably preserved during organic conversion.
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[1] Y. Peng et al., Universal approach to fabricating graphene-supported single-atom catalysts, ACS Cent. Sci. 6 (2020).
[2] L. Liu, A. Corma, Metal catalysts for heterogeneous catalysis: from single atoms to nanoclusters and nanoparticles, Chem. Rev. 118 (2018) 4981-5079.
[3] W. Zhang et al., Understanding single-atom catalysis in view of theory, JACS Au 1 (2021).
[4] X. Song et al., Graphene-supported single nickel atom catalyst, ACS Appl. Mater. Interfaces 12 (2020).
[5] X. Wang et al., Graphene-supported single-atom Ni for direct CH4-to-CH3OH conversion: theoretical insight, J. Phys. Chem. C 127 (2023).
[6] Highly efficient bimetallic single-atom catalysts for C-C coupling on graphene, ACS Nano (2026).
[7] Theoretical understandings of graphene-based metal single-atom catalysts, Chem. Rev. 120 (2020).
[8] Single-atom catalysts through pressure-controlled metal deposition, J. Am. Chem. Soc. (2024).
[9] In situ observation of the motion of platinum and gold single atoms on graphene, J. Phys. Chem. C (2022).
[10] Graphene-supported tin single-atom catalysts for CO2 hydrogenation to formic acid: a DFT study, ACS Appl. Nano Mater. (2023).
[11] Supported single Fe atoms prepared via atomic layer deposition, ACS Appl. Nano Mater. (2020).
[12] B. Qiao et al., Single-atom catalysis of CO oxidation using Pt1/FeOx, Nat. Chem. 3 (2011) 634-641.
[13] X.F. Yang et al., Single-atom catalysts: a new frontier in heterogeneous catalysis, Acc. Chem. Res. 46 (2013) 1740-1748.
[14] A. Wang, J. Li, T. Zhang, Heterogeneous single-atom catalysis, Nat. Rev. Chem. 2 (2018) 65-81.
[15] S. Mitchell, E. Vorobyeva, J. Pérez-Ramírez, The multifaceted reactivity of single-atom heterogeneous catalysts, Angew. Chem. Int. Ed. 57 (2018).
[16] J. Liu, Catalysis by supported single metal atoms, ACS Catal. 7 (2017) 34-59.
[17] H. Fei et al., Atomic cobalt on nitrogen-doped graphene for catalytic reactions, Nat. Commun. (2015).
[18] Customized heteroelement dopants on graphene for single-atom catalysis, Acc. Mater. Res. (2021).
[19] Electronic and geometric effects in single-atom selective hydrogenation, ACS Catal. (2016).
[20] Dynamic catalytic structures of single-atom catalysts under reaction conditions, Nat. Catal. (2020).
[21] Single-atom catalysts: synthesis and sustainable applications, ACS Sustainable Chem. Eng. special collection (2025-2026).
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Copyright (c) 2026 Dr.Narayana Gundoju, B. Jyothi, B. Sowmya, Dinesh Kumar, A. Pavani, A. Madhuri (Author)

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