陈俊，2010年毕业于南京大学化学化工学院获得学士学位；2016年毕业于中国科学院大连化学物理研究所获得博士学位；2016年至2019年从事博士后研究工作；2019年11月至今，任研究员。长期从事势能面与反应动力学理论发展与应用，人工智能算法的发展和应用，建立了高精度机器学习势函数方法，并发展了一系列微观分子动力学与反应机理研究方法，以及针对先进材料的探索设计与稳定性表征理论方法。主要研究方向为理论计算化学、经典与量子化学反应动力学，结合高等级电子结构方法与机器学习技术，构造化学反应势能面，用于化学反应动力学计算，探索气相与固体表面体系的化学反应微观机制。主持国家自然科学基金面上项目、青年项目，曾获中国科学院院长特别奖，入选首批博新计划，福建省高层次引进人才，获中国科学院海西研究院“团队百人”计划支持。

1. S. Lin, R. Xiong, J. Chen*, S. Lin*, Spillover Dynamics in Heterogeneous Catalysis on Single-Atom Alloys: A Theoretical Perspective, WIREs Computational Molecular Science, 2025, doi: 10.1002/wcms.70011

2. C. Li#, X. Chen#, T. Jin, T. Wu*, J. Chen*, W. Zhuang*, Impact of Functional Groups within the Spacer Cation on the Properties of Two-Dimensional Monolayer Perovskites, Nano Materials Science, 2025, doi: 10.1016/j.nanoms.2024.02.005

3. Q. Zhou, X.-M. Chen, X. Qin, Z.-N. Chen*, J. Chen*, W. Zhuang*, The Counterintuitive Aromaticity of Bent Metallabenzenes: A Theoretical Exploration, Chinese Chemical Letters, 2025, 36(4), 109770.

4. Z. Tan, J. Chen*, S. Lin*, Theoretical Insights into H₂ Activation and Hydrogen Spillover on Near-Surface Alloys with Embedded Single Pt Atoms, ACS Catalysis, 2024, 14(4), 2194–2201.

5. J. Chen*, T. Jin, Z.-N. Chen, C. Liu, W. Zhuang*, Adsorption Kinetics of H₂O on Graphene Surface based on a new Potential Energy Surface, Artificial Intelligence Chemistry, 2024, 2, 100046.

6. J. Chen*, F. Wang*, X. Xu*, A global ²A" state Potential Energy Surface for the Al (²P) + O₂ (³Σg⁻) → AlO (²Σ⁺) + O (³P) Reaction based on the Doubly Hybrid Functional XYG3, The Journal of Chemical Physics, 2023, 159(22), 224303.

7. X. Zhan#, X. Chen#, C. Li, T. Jin, Y. Wang, Z.-N. Chen, T. Wu*, J. Chen*, W. Zhuang*, Can Lead-free Double Halide Perovskites Serve as Proper Photovoltaic Absorber?, The Journal of Physical Chemistry Letters, 2023, 14(48), 10784−10793.

8. X. Xu#, J. Chen#, X. Lu, W. Fang, S. Liu, D. H. Zhang*, Strong Non-Arrhenius Behavior at Low Temperatures in the OH + HCl → H₂O + Cl Reaction due to Resonance Induced Quantum Tunneling, Chemical Science, 2022, 13, 7955-7961.

9. J. Chen#, T. Jin#, Y. Jiang, T. Shen*, M. Yang*, Z.-N. Chen*, Toward Accurate and Efficient Dynamic Computational Strategy for Heterogeneous Catalysis: Temperature-Dependent Thermodynamics and Kinetics for the Chemisorbed on-surface CO, Chinese Chemical Letters, 2022, 33(11), 4936-4942.

10. Z. Shi, Y. Jiang, J. Yu, S. Chen*, J. Chen*, Z. Tang*, L. Zheng, Develop the Low-Temperature Oxidation Mechanism of Cyclopentane: An Experimental and Theoretical Study, Chemistry-A European Journal, 2022, 28(8), e202103546.

11. J. Chen, S. Hariharan, J. Meyer, H. Guo*, Potential Energy Landscape of CO Adsorbates on NaCl(100) and Implications in Isomerization of Vibrationally Excited CO, The Journal of Physical Chemistry C, 2020, 124(35), 19146-19156.

12. Z. Chen#, J. Chen#, R. Chen, T. Xie, X. Wang, S. Liu*, G. Wu*, D. Dai, X. Yang*, D. H. Zhang* Reactivity Oscillation in the Heavy-Light-Heavy Cl + CH₄ Reaction, Proceedings of the National Academy of Sciences of the United States of America, 2020, 117(17), 9202-9207.

13. J. Chen#, N.Q. Su#, X. Xu*, D. H. Zhang* Accurate potential Energy Surfaces for Hydrogen Abstraction Reactions: A Benchmark Study on the XYG3 Doubly Hybrid Density Functional, Journal of Computational Chemistry, 2017, 38(27), 2326-2334.

14. T. Yang#, J. Chen#, L. Huang, T. Wang, C. Xiao*, Z. Sun*, D. Dai, X. Yang*, D. H. Zhang*, Extremely Short-Lived Reaction Resonances in Cl + HD (v = 1) → DCl + H due to Chemical Bond Softening, Science, 2015, 347(6217), 60-63.

15. T. Wang#, J. Chen#, T. Yang, C. Xiao*, Z. Sun*, L. Huang, D. Dai, X. Yang*, D. H. Zhang*, Dynamical Resonances Accessible Only by Reagent Vibrational Excitation in the F + HD → HF + D Reaction, Science, 2013, 342(6165), 1499-1502.