Jian Zhao

8PUBLICATIONS
14CO-AUTHORS
Theoretical quantum chemistryMetal cluster chemistryOrganic chemical synthesisElectrochemical energy storage and conversionCatalysis and mechanisms of reactions
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Publications (8)

|Sep 01, 2026
Accelerating KSpot Charge Evaluation in Nucleic Acids via ABEEM Polarizable Force Field.

|Jul 31, 2026
Structural Evolution of Hydrated Alkaline-Earth Metal Ion Clusters via Molecular Face Theory with Kohn-Sham One-Electron Potential.

|Jan 27, 2026
Upgrading CO2 and H2O to Analytical-Grade Propanal via an Electrocatalysis-Thermal Catalysis Relay on Single-Atom Catalysts.

Shifu Wang, Jian Gu, Xiaobo Yang

|Nov 10, 2025
Unraveling the Dynamic Low-Spin State Evolution of Single-Fe-Atom Sites for Efficient CO2 Electroreduction.

Yaqiong Zeng, Jian Zhao, Shifu Wang

|Oct 14, 2025
The ABEEM/MM Calcium Polarizable Force Field: Parameterization and Applications in Aqueous Solutions and Protein Segments.

Runqiang Yu, Linan Lu, Linlin Liu

|Aug 15, 2024
Open-cage metallo-azafullerenes as efficient single-atom catalysts toward oxygen reduction reaction.

Haiyang Gao, Hairui Cai, Gege Yang

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Frequent Collaborators

4 joint publications

Zhongzhi Yang

3 joint publications

Dongxia Zhao

2 joint publications

Lidong Gong

2 joint publications

Bin Liu