Zhongjun Zhou

13PUBLICATIONS
10CO-AUTHORS
Catalysis and mechanisms of reactionsPhotochemistryData structures and algorithmsChemical and thermal processes in energy and combustionComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)
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Publications (13)

|Jan 16, 2026
Theoretical investigation of the excited-state dynamics in the CH4 + O(3P) → CH3 + OH reaction.

Haohan Xie, Zexing Qu, Huiling Liu

|Dec 09, 2025
The Mechanism of Photocatalytic C(sp3)-H Activation by Decatungstate Anion: CPET or HAT?

Zhongjun Zhou, Qixuan Ye, Ronglin Zhong

|Nov 28, 2025
Machine Learned Fock Matrix.

Hongcai Liu, Shuai Guan, Zhuofan Wang

|Oct 18, 2025
Machine Learning-Based Excited-State Reactive Force Field: A New Approach for Modeling the Photodissociation Dynamics of 2-Fluorothiophenol.

Xinyu Huang, Zhongjun Zhou, Huajie Song

|Aug 12, 2024
Many-Body Expansion-Based Quantum Mechanical Force Field for Cyclotrimethylene Trinitramine under High Pressure.

Shuai Guan, Huajie Song, Zhongjun Zhou

|Mar 04, 2024
Diradical-Based Strategy in Designing Narrowband Thermally Activated Delayed Fluorescence Molecules with Tunable Emission Wavelengths.

Shaoqin Zhang, Zhongjun Zhou, Zexing Qu

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Frequent Collaborators

11 joint publications

Zexing Qu

2 joint publications

Jilong Zhang

2 joint publications

Wenjian Liu

1 joint publications

Fang Ma