1、计算材料学（低维功能材料设计）
1) Hu,L.; Wang, F.; Jing, Y.* High Catalytic Activity of Co-centered 2D Metal Organic Frameworks toward Bifunctional Oxygen Evolution and Reduction Reactions: Rationalized by Spin Polarization Effect. J. Phys. Chem. Lett. 2023, 14, 11429−11437.
2) Jing, Y.*; Zhu, X.; Maier, S.; Heine, T. 2D Conjugated Polymers: Exploiting Topological Properties for the Rational Design of Metal-Free Photocatalysts. Trends Chem. 2022, 4, 792-806.
3) Jing, Y.;* Zhou, Z.; Geng, W.; Zhu, X.; Heine, T.* 2D Honeycomb-Kagome Polymers as Effective Metal-Free Photocatalysts for Water Splitting. Adv. Mater. 2021, 33, 2008645.
4) Zhou, Z.; Springer, M. A.; Geng, W.; Zhu, X.; Li, T.; Li, M.; Jing, Y.*; Heine, T. * Rational Design of Two-Dimensional Binary Polymers from Heterotriangulenes for Photocatalytic Water Splitting. J. Phys. Chem. Lett. 2021, 12, 8134−8140.
5) Jing, Y.; Heine, T.* Two-Dimensional Kagome Lattices Made of Hetero Triangulenes Are Dirac Semimetals or Single-Band Semiconductors. J. Am. Chem. Soc. 2019, 141, 743-747.
6) Jing, Y.; Heine, T.* Making 2D topological polymers a reality. Nature Mater. 2020, 19, 823-824.
2、储能机制与有机电极材料开发（锂离子电池，钠离子电池，光充电电池）
1) Jiang, L.; Wang, J.; Yang, Y.; Zhu, Z.; Cao, X.; Zhou, Y.; Tang, Y.; Wu, P.*; Jing, Y.*; Li, R.*; Fan,X. Dynamically Forming Interconnected Interfaces in Confined Heterostructures Enable High Capacity Conversion Chemistry. Adv. Energy Mater. 2024, 2400498.
2) Shu,X.; Hu,L.; Heine, T.*; Jing, Y.* Rational Molecular Design of Redox-Active Carbonyl-Bridged Heterotriangulenes for High-Performance Lithium-Ion Batteries. Adv. Sci. 2023, 2306680.
3) Zhu, X.; Yang, Y.; Shu, X.; Jing, Y.* Computational insights into the rational design of organic electrode materials for metal ion batteries. WIREs Comput. Mol. Sci. 2023: e1660.
4) Zhu, X.; Jing, Y.* Natural quinone molecules as effective cathode materials for nonaqueous lithium-ion batteries. J. Power Sources 2022, 531, 231291.
5) Jing, Y.; Zhou, Z.* Computational Insights into Oxygen Reduction Reaction and Initial Li2O2 Nucleation on Pristine and Nitrogen Doped Graphene in Li-O2 Batteries. ACS Catal. 2015, 5, 4309-4317.
3、催化转化机制与生物质资源增值提质技术
1) Li, T.; Liu, T.; Hu,L.; Jing, Y.* Selective Hydrodeoxygenation of Phenol Driven by Synergistic Effects of Dual-Metal Atoms Over C2N Monolayer. ACS Catal. 2024, 14, 7220-7231.
2) Hu, L.; Li, T.; Jing, Y.* Thermal Pyrolysis Behavior and Decomposition Mechanism of Lignin Revealed by Stochastic Cluster Dynamics Simulations. J. Phys. Chem. C. 2024,128,3832-3838.
3) Zhao, E.; Li, M.; Xu, B.; Wang, X.; Jing, Y.*; Ma, D.; Mitchell, S.; Pérez-Ramírez, J.*; Chen. Z.* Transfer hydrogenation with a carbon-nitride-supported palladium single-atom photocatalyst and water as a proton source. Angew. Chem. Int. Ed. 2022, 61, e202207410.