58. General workflow for localizing hydrides in metal nanoclusters by combining stochastic surface walking with neural-network potentials. (featured in Nature Communications Editors' Highlights)

Zhuang Wang, Cong Fang, Lili Zhang, Wenshuai Zhu, Yuxiao Ding*, Sicong Ma*, Xiaoyan Sun*.

Nat. Commun. 2026, 17, 4513.  https://www.nature.com/articles/s41467-026-72966-9

57. Selective Azobenzene Production by Defective Zirconium Metal–Organic Frameworks–Catalyzed Oxidative Coupling of Aniline in Water under Ambient Pressure of Oxygen. (invited paper)

Zilong Li, Dapeng Meng, Cong Fang, Lili Zhang, Yuxiao Ding*, Qiang Liu*, Xiaoyan Sun*.

ChemCatChem. 2026, 18, 9: e7077. https://doi.org/10.1002/cctc.70772

56. Probing the Reactivity Limits of Microdroplets via Thermometer Ions: A Case of Unimolecular Dissociation

Jian Zhou, Qing Wang, Dingding Lv*, Xiaoyan Sun*.

J. Phys. Chem. Lett. 2026, 17,15,4577–4583. https://pubs.acs.org/doi/full/10.1021/acs.jpclett.5c03876

55. Ion Mobility–Mass Spectrometry: A Powerful Platform for Structural Characterization of Metal Nanoclusters

Longbo Zhang, Lili Zhang*, Xiaoyan Sun*.

Anal. Chem. 2026, 98, 12, 8705-8729. https://doi.org/10.1021/acs.analchem.5c07216

54. Insights into Single-Atom Catalysts on Oxygen Functionalized Carbon Nanotubes.

Yuying Dang, Pascal Düngen, Jieyong Hao, Duo Zeng, Chaoan Liang, Xing Huang, Xiaoyan Sun*, Robert Schlögl, Chungu Xia, Yuxiao Ding*, Saskia Heumann*.

Green Carbon. 2026, https://doi.org/10.1016/j.greenca.2025.10.009