journal article·2026-05Open access

How the curvature-rich structure of N-doped graphene enables asymmetric polysulfide redox catalysis for highly promising Li–S batteries

Lijing Wang, Chang Wu, Yu Gao, Hongfang Du, Shailendra K. Sharma, Aaron T. Marshall, Yang Liu, Yi Zhao, Shixue Dou, Liang Huang, Shaowei Zhang, Chao Wu, Liangxu Lin

eScience· Volume 6· Issue 3

Abstract

The catalytic conversion of polysulfides remains a critical bottleneck in the development of high-performance lithium–sulfur batteries (LSBs). Despite extensive efforts to engineer carbon-based materials for LSBs, such as nitrogen (N)-doped graphene, the intrinsic limitations of conventional N-doped configurations have hindered catalytic effectiveness. Here, we reveal how the curvature-rich structure of N-doped graphene (N-CR-G) regulates catalytic properties to promote the sulfur reduction reaction (SRR). This architecture induces a diversity of active N configurations and optimizes the local electronic structure, directly accelerating the polysulfide redox kinetics. Unlike conventional carbon-based materials, the main N-doped configuration of N-CR-G catalyzes an uncommon asymmetric reaction pathway involving the rapid generation of soluble radicals, effectively suppressing the accumulation of insoluble Li 2 S 2 intermediates and enhancing sulfur utilization. While the curvature structure also facilitates carbon vacancy formation and enables room-temperature N doping, its primary contribution lies in tailoring the catalytic landscape of graphene. This work underscores the significance of curvature engineering for activating and regulating electrocatalytic behavior, offering a powerful strategy to design advanced cathode materials for highly promising LSBs. • Curvature-engineered N-doped graphene with multi-configurational active sites was developed, enabling synergistic enhancement of polysulfide adsorption and asymmetric redox catalysis in Li–S batteries. • The design accelerates sulfur conversion via the -mediated pathway, suppresses Li 2 S 2 accumulation, and achieves exceptional cycling stability (<0.05% decay per cycle), surpassing conventional N-doped graphene. • Theoretical and experimental analyses reveal curvature-induced electronic modulation and doping facilitation, clarifying the origin of the superior areal capacity and long-term cyclability.
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OpenAlex topics: Advanced Battery Materials and Technologies · Advancements in Battery Materials · Inorganic Chemistry and Materials

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References (57)

Show source-provided references
1. A fundamental look at electrocatalytic sulfur reduction reaction10.1038/s41929-020-0498-x ↗
2. Li-S batteries: challenges, achievements and opportunities10.1007/s41918-023-00188-4 ↗
3. Visualizing interfacial collective reaction behaviour of Li-S batteries10.1038/s41586-023-06326-8 ↗
4. MXenes: synthesis strategies and lithium-sulfur battery applications10.1016/j.esci.2022.02.010 ↗
5. Manganese-incorporated single-phase high-entropy oxide modified separator enabled high performance of lithium-sulfur batteries at high sulfur loading10.1002/eem2.70058 ↗
6. Harnessing high entropy sulfide (HES) as a robust electrocatalyst for long-term cycling of lithium-sulfur batteries10.1002/eem2.70007 ↗
7. Titanium-containing high entropy oxide (Ti-HEO): a redox expediting electrocatalyst towards lithium polysulfides for high performance Li-S batteries10.26599/NRE.2024.9120116 ↗
8. Thickness-independent scalable high-performance Li-S batteries with high areal sulfur loading via electron-enriched carbon framework10.1038/s41467-021-24873-4 ↗
9. Non-metal iodine single-atom catalysts anchored on N-doped graphene for high-performance lithium-sulfur battery
10. High-quality mesoporous graphene particles as high-energy and fast-charging anodes for lithium-ion batteries10.1038/s41467-019-09274-y ↗
11. Single-dispersed polyoxometalate clusters embedded on multilayer graphene as a bifunctional electrocatalyst for efficient Li-S batteries10.1038/s41467-021-27866-5 ↗
12. An electrocatalytic model of the sulfur reduction reaction in lithium-sulfur batteries10.1002/anie.202211448 ↗
13. Hydrothermal preparation of nitrogen, boron co-doped curved graphene nanoribbons with high dopant amounts for high-performance lithium sulfur battery cathodes10.1039/C7TA01265A ↗
14. Understanding the interaction of N-doped graphene and sulfur compounds in a lithium-sulfur battery: a density functional theory investigation10.1039/D2NJ01662A ↗
15. A porous nitrogen and phosphorous dual doped graphene blocking layer for high performance Li-S batteries10.1039/C5TA04255K ↗
16. N-doping of graphene oxide at low temperature for the oxygen reduction reaction10.1039/C6CC08776K ↗
17. Collaborative design of Li-S batteries using 3D N-doped graphene aerogel as a sulfur host and graphitic carbon nitride paper as an interlayer10.1039/C7SE00291B ↗
18. Synergetic pore structure optimization and nitrogen doping of 3D porous graphene for high performance lithium sulfur battery10.1016/j.carbon.2018.11.032 ↗
19. A comparison study of the electrocatalytic sulfur reduction activity on heteroatom-doped graphene for Li-S battery10.1002/sstr.202200244 ↗
20. Chemical dopants on edge of holey graphene accelerate electrochemical hydrogen evolution reaction10.1002/advs.201900119 ↗
21. Nitrogen-doped holey graphene for high-performance rechargeable Li-O batteries10.1021/acsenergylett.6b00128 ↗
22. High-density monolith of n-doped holey graphene for ultrahigh volumetric capacity of Li-ion batteries
23. Physical activation of graphene: an effective, simple and clean procedure for obtaining microporous graphene for high-performance Li/S batteries10.1007/s12274-019-2282-2 ↗
24. Lithium batteries: the regulating role of carbon nanotubes and graphene in lithium-ion and lithium-sulfur batteries
25. Curvature-regulated sulfur electrochemistry for robust low-temperature Li-S batteries10.1016/j.jechem.2025.02.005 ↗
26. Unveiling the curvature-dependent electrocatalytic kinetics for sulfur redox reaction in Li-S chemistry
27. Engineering contact curved interface with high-electronic-state active sites for high-performance potassium-ion batteries10.1073/pnas.2307477120 ↗
28. Understanding the curvature effect of FeCo nanoalloy encapsulated by nitrogen-doped carbon nanotubes for high-performance lithium-sulfur batteries
29. Understanding the interactions between lithium polysulfides and N-doped graphene using density functional theory calculations10.1016/j.nanoen.2016.04.053 ↗
30. Crystal engineering strategies for advanced electrocatalysts in lithium-sulfur batteries10.1016/j.mattod.2025.02.022 ↗
31. Integrating conductivity, immobility, and catalytic ability into high-N carbon/graphene sheets as an effective sulfur host
32. Biotemplating growth of nepenthes-like N-doped graphene as a bifunctional polysulfide scavenger for Li-S batteries10.1021/acsnano.8b05246 ↗
33. Facilitating polysulfide confinement using N-doped honeycomb-like carbon with high pyridinic-nitrogen content for high-performance Li-S batteries10.1007/s40843-022-2387-1 ↗
34. Fast activation of graphene with a highly distorted surface and its role in improved aqueous electrochemical capacitors10.1021/acsaem.2c00444 ↗
35. Effective solvothermal deoxidization of graphene oxide using solid sulphur as a reducing agent10.1039/c2jm31940c ↗
36. Formation of tunable graphene oxide coating with high adhesion10.1039/C5CP06906H ↗
37. Surface energy engineering in the solvothermal deoxidation of graphene oxide10.1002/admi.201300078 ↗
38. Mechanism and kinetics of Li2S precipitation in lithium-sulfur batteries10.1002/adma.201501559 ↗
39. A nitrogen and sulfur dual-doped carbon derived from polyrhodanine@cellulose for advanced lithium-sulfur batteries10.1002/adma.201502467 ↗
40. Healable and conductive sulfur iodide for solid-state Li-S batteries10.1038/s41586-024-07101-z ↗
41. A cooperative interface for highly efffcient lithium-sulfur batteries10.1002/adma.201603401 ↗
42. Redox comediation with organopolysulfides in working lithium-sulfur batteries10.1016/j.chempr.2020.09.015 ↗
43. Surface-enhanced redox chemistry of polysulphides on a metallic and polar host for lithium-sulphur batteries10.1038/ncomms5759 ↗
44. Sputtered MoN nanolayer as a multifunctional polysulfide catalyst for high-performance lithium-sulfur batteries10.1016/j.esci.2022.03.003 ↗
45. The dual functions of defect-rich carbon nanotubes as both conductive matrix and efffcient mediator for Li-S batteries10.1002/smll.202103535 ↗
46. Understanding synergistic catalysis on Pt-Cu diatomic sites via operando x-ray absorption spectroscopy in sulfur redox reactions10.1016/j.esci.2023.100222 ↗
47. Non-trivial contribution of carbon hybridization in carbon-based substrates to electrocatalytic activities in Li-S batteries
48. Revealing the role of crystal structure to catalysis: inverse spinel phase co-mn-based catalyst for Li-S batteries
49. Integrating sub-nano catalysts into metal-organic framework toward pore-confined polysulfides conversion in lithium-sulfur batteries10.1002/adfm.202304619 ↗
50. Establishing reaction networks in the 16-electron sulfur reduction reaction10.1038/s41586-023-06918-4 ↗
51. 3D holey graphene/polyacrylonitrile sulfur composite architecture for high loading lithium sulfur batteries
52. In situ/operando Raman techniques in lithium-sulfur batteries
53. Selective catalysis remedies polysulfide shuttling in lithium-sulfur batteries10.1002/adma.202101006 ↗
54. In situ/operando characterization techniques for rechargeable lithium-sulfur batteries: a review10.1039/C7NR06819K ↗
55. Fe and Co containing N-doped graphene sulfur cathode for high performance Li-S batteries and in situ Raman investigation
56. The quest for polysulfides in lithium-sulfur battery electrolyte: an operando confocal Raman spectroscopy study10.1002/cphc.201500448 ↗
57. In-situ free radical supplement strategy for improving the redox kinetics of Li-S batteries10.1016/j.ensm.2023.02.023 ↗