1. Sun, XiaoYing; Xue, J.; Ren, Y.; Li, X.; Zhou, L.; Li, B.; Zhao, Z.* Revealing Nature of Active Site and Reaction Mechanism of Supported Chromium Oxide Catalyst in Propane Direct Dehydrogenation. Molecular Catalysis 2021, 505, 111520.
2. Sun, XiaoYing; Xue, J.; Ren, Y.; Li, X.; Zhou, L.; Li, B.; Zhao, Z.* Catalytic Property and Stability of Subnanometer Pt Cluster on Carbon Nanotube in Direct Propane Dehydrogenation. Chinese Journal of Chemistry 2021, 39, 661–665.
3.Sun, XiaoYing; Liu, M.; Huang, Y.; Li, B.; Zhao, Z.* Electronic Interaction between Single Pt Atom and Vacancies on Boron Nitride Nanosheets and Its Influence on the Catalytic Performance in the Direct Dehydrogenation of Propane. Chinese Journal of Catalysis 2019, 40, 819–825.
4. Sun, XiaoYing; Han, P.; Li, B.; Zhao, Z.* Tunable Catalytic Performance of Single Pt Atom on Doped Graphene in Direct Dehydrogenation of Propane by Rational Doping: A Density Functional Theory Study. The Journal of Physical Chemistry C 2018, 122 (3), 1570–1576.
5. Sun, XiaoYing; Han, P.; Li, P.; Li, B.; Zhao, Z.* DFT Study on the Active Site of the Monometric Molybdenum Anchored on Silica for the Selective Oxidation of Ethane to Acetaldehyde. Molecular Catalysis 2018, 460, 83–86.
6.Sun, XiaoYing; Han, P.; Li, B.*; Mao, S.; Liu, T.; Ali, S.; Lian, Z.; Su, D.* Oxidative Dehydrogenation Reaction of Short Alkanes on Nanostructured Carbon Catalysts: A Computational Account. Chemical Communications 2018, 54, 864–875.
7. Sun, XiaoYing; Li, B.*; Su, D.* The Unexpected Reactivity of the Carbon Sites on the Nanostructured Carbon Catalysts towards the C−H Bond Activation from the Analysis of the Aromaticity. Chemistry – An Asian Journal 2016, 11, 1668–1671.
8. Sun, XiaoYing; Li, B.*; Liu, T.; Song, J.; Su, D.* Designing Graphene as a New Frustrated Lewis Pair Catalyst for Hydrogen Activation by Co-Doping. Phys. Chem. Chem. Phys. 2016, 18 (16), 11120–11124.
9. Sun, XiaoYing; Li, B.; Su, D.* Revealing the Nature of the Active Site on the Carbon Catalyst for C-H Bond Activation. Chemical Communications 2014, 50 (75), 11016–11019.
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