Zexing Qu

32PUBLICATIONS
45CO-AUTHORS
Medical and biological physics not elsewhere classifiedElectrical energy generation (incl. renewables, excl. photovoltaics)Integrable systems (classical and quantum)Catalysis and mechanisms of reactionsPhotochemistry
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Publications (32)

|Nov 05, 2026
Normal-Mode-Based Nudged Band (NM-NEB) Method: Retrieving Potential Energy Surface Information from Local Hessians to Improve Transition State Search.

|Oct 24, 2026
Electronic Coupling and Dual-Spillover Effect in Co/Co7Fe3 Heterointerface for Boosting Nitrate-to-Ammonia Conversion.

|Sep 28, 2026
New features of BDF since 2020.

|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

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Frequent Collaborators

13 joint publications

Zhongjun Zhou

4 joint publications

Haisheng Ren

3 joint publications

Wenjian Liu

3 joint publications

Jiali Gao