发表论文：

1. Yang, L.; Wang, P.*; Yang, Z.; Pei, Y.* Effect of Thiolate-Ligand Passivation on the Electronic Structure and Optical Absorption Properties of Ultrathin one and Two-Dimensional Gold Nanocrystals, Nanoscale, 2020, 12, 5554-5566. 

2. Hao, Z.; Zhang, K.; Wang, P*.; Lu, X.; Lu, Z*.; Zhu, W*.; Liu, Y*. Deep Red Iridium(III) Complexes Based on Pyrene-Substituted Quinoxaline Ligands for Solution-Processed Phosphorescent Organic Light-Emitting Diodes. Inorg. Chem. 2020, 59, 332-342.

3. Pei, Y.*; Wang, P.; Ma, Z.; Xiong, L.; Growth-Rule-Guided Structural Exploration of Thiolate-Protected Gold Nanoclusters, Acc. Chem. Res, 2019, 52, 23-33.

4. Zhao, X.; Wang, P.; Ma, Z.; Pei, Y*. A Phenyl Ring Transfer Mechanism of Styrene Selective Oxidation to Phenyl Acetaldehyde on Gold Catalysts from Density Functional Theoretical Studies. J. Phys. Chem. C. 2019, 123, 3, 1710-1719  (共同一作) 

5. Wang, P.; Xiong, L.; Sun, X. X.; Pei, Y. Exploring the Structure Evolution and Core/Ligand Structure Patterns of a Series of Large Size Thiolate-Protected Gold Clusters Au_145-3N(SR)_60-2N (N=1-8): A First Principle Study. Nanoscale. 2018, 10, 3918-3929. (评为2018年nanoscale热点文章)

6. Wang, P.; Sun, X.; Liu, X.; Xiong, L.; Ma, Z.; Wang, Y.; Pei Y*. A Revisit to the Structure of Au₂₀(SCH₂CH₂Ph)₁₆: a Cubic Nanocrystal-Like Gold Kernel, Nanoscale, 2018, 10, 10357-10364.

7. Wang, P.; Sun, X. X.; Liu, X.; Xiong, L.; Ma, Z.; Pei, Y. Theoretical Predictions of a New ~14 kDa Thiolate-Protected Gold Nanoparticle: Au₆₈(SR)₃₆ Core-Mass. J. Phys.Chem. Lett. 2017, 8, 1248-1252. 

8. Zhu, M.; Wang, P.; Yan, N*.; Qi, C. X.; He, L. Z.; Zhao, Y.;  Xia, N.; Yao, C. H.; Li, J.; Deng, H. T.; Zhu, Y.; Pei, Y*.; Wu Z. K*. The Fourth Alloying Mode by Way of Anti-Galvanic Reaction. Angew. Chem. Int. Ed. 2018. DOI: 10.1002/anie.201800877. (共同一作) 

9. Wang, P.; Tang, X.; Tang, J.; Pei, Y*. Density Functional Theory (DFT) Studies of CO Oxidation over Nanoporous Gold: Effects of Residual Ag and CO Self-Promoting Oxidation. J. Phys .Chem. C. 2015, 119, 10345-10354. 

11. Liu, B.; Wang, P.; Aaron Lopes, A.; Jin, L.; Zhong, W.; Pei, Y*.; Suib, S. L.; He, J*. Au−Carbon Electronic Interaction Mediated Selective Oxidation of Styrene. ACS Catal. 2017, 7, 3483−3488. 

12. Liao, L.; Zhuang, S.; Wang, P.; Xu, Y.; Yan, N.; Dong, H.; Wang, C.; Zhao, Y.; Xia, N.; Li, J.; Deng, H.; Pei, Y.; Tian S-K.; Wu, Z*. Quasi-Dual-Packed-Kerneled Au₄₉ (2,4-DMBT)₂₇ Nanoclusters and the Influence of Kernel Packing on the Electrochemical Gap. Angew Chem Int Ed. 2017,56, 12644–12648.

13. Ma, Z.; Wang, P.; Xiong, L.; Pei, Y*. Thiolate-Protected Gold Nanoclusters: Structural Prediction and the Understandings of Electronic Stability from First Principles Simulations. Comput Mol Sci. 2017, e1315. 

14. Ma, Z.; Wang, P.; Pei, Y*. Geometric Structure, Electronic Structure and Optical Absorption Properties of One-Dimensional Thiolate-Protected Gold Clusters Containing a Quasi-Face-Centered-Cubic (quasi-fcc) Au-Core: a Density Functional Theoretical Study. Nanoscale, 2016, 8, 17044-17054. 

15. Ma, Z.; Wang, P.; Zhou, G.; Tang, J.; Li, H.; Pei, Y*. Correlating the Structure and Optical Absorption Properties of Au₇₆(SR)₄₄ Cluster. J. Phys. Chem. C. 2016, 120, 13739–13748. 

16. Xiong, L.; Peng, B.; Ma, Z.; Wang, P.; Pei, Y. Ten-Electron (10e) Thiolate-Protected Au₂₉(SR)₁₉ Cluster: Structure Prediction and A ‘Gold-Atom Insertion, Thiolate-Group Elimination’Mechanism. Nanoscale. 2017, 9, 2895-2902.

科研项目：

1. 主持国家自然科学基金青年项目1项（2021-2023）

2. 主持湖南省自然科学基金青年项目1项（2020-2022）

3. 主持广东省区域联合基金青年项目1项（2020-2022）

汪璞，女，湖南省岳阳市人，主要从事配体保护贵金属纳米团簇的结构、光学性质、生长机制和催化性质的理论计算研究。2018年8月进入湘潭大学化学学院工作，加入裴勇教授课题组团队。欢迎有志从事贵金属纳米材料的理论研究的学子报考。