All Stories

  1. Structural evolution beyond carbon fullerenes: A family of metal–oxo clusters

    Article • Proceedings of the National Academy of Sciences, August 2026, Proceedings of the National Academy of Sciences

    Xiaokun Zhao

  2. Catalytic reduction of N 2O by CO molecules using transition metal-phosphomolybdic acid (TM 1/PMA) single-atom catalysts: A theoretical perspective

    Article • Nano Research Energy, June 2025, Tsinghua University Press

    Xiaokun Zhao

  3. Spectroscopic snapshot for neutral water nonamer (H2O)9: Adding a H2O onto a hydrogen bond-unbroken edge of (H2O)8

    Article • The Journal of Chemical Physics, January 2023, American Institute of Physics

    Ling Jiang, Xiaokun Zhao

  4. On the gold–ligand covalency in linear [AuX2]− complexes

    Article • Dalton Transactions, January 2015, Royal Society of Chemistry

    Prof Lai-Sheng Wang, Xiaokun Zhao

  5. Theoretical and experimental studies of the interactions between Au2− and nucleobases

    Article • Physical Chemistry Chemical Physics, January 2014, Royal Society of Chemistry

    Xiaokun Zhao