孙雅静 Sun Yajing
邮箱：syj19@tju.edu.cn
学习工作经历：
2022.04-至今 副教授 天津大学 理学院
2019.08-2022.03 讲师 天津大学 理学院
2014.09-2019.07 理学博士 清华大学 化学系 导师：帅志刚 教授
2010.09-2014.07 理学学士 山东大学 化学与化工学院 化学基地班
主要研究方向：理论计算化学（材料性能计算 & 新方法开发）
1. 分子光电材料：有机小分子光电材料电荷传输及光物理性质的理论计算及性能调控；
2. 低维功能材料：新颖电子结构、热电性质的计算及高性能材料设计；
3. 凝聚态材料电/声相关性质的多尺度方法开发 & 机器学习算法框架搭建及模型训练。
代表性论文:
1. XX Niu, YF Dang, YJ Sun*, WP Hu*, Judicious training pattern for superior molecular reorganization energy prediction model, J. Energy Chem. 2023, 81,143-148.
2. YR Bao, YJ Sun*, F Jiao*, WP Hu, Recent Advances in Multicomponent Organic Composite Thermoelectric Materials, Adv. Electron. Mater. 2023, 2201310.
3. JJ Li, YJ Sun*, ZC Zhang, Perspective on machine learning in energy material discovery, SmartMat. 2023, e1171.
4. XY Lu, YX Hu, HP Liu, JN Qi, XS Chen, YJ Sun*, WP Hu* Hu Excited State Properties of Aggregation-Induced Delayed Fluorescence Molecules: A Microscopic Insight, Adv. Opt. Mater., 2022, 10, 2201075.
5. YJ Sun, WP Hu* Novel machine learning framework for thermal conductivity prediction by crystal graph convolution embedded ensemble, SmartMat. 2022, 3, 474-481.
6. XY Lu, YJ Sun*, WP Hu* The external electric field effect on the charge transport performance of organic semiconductors: a theoretical investigation, J. Mater. Chem. A, 2021, 9, 21044-21050.
7. XY Lu, YJ Sun*; ZC Zhang; ZG Shuai, WP Hu*, Simultaneous studies of pressure effect on charge transport and photophysical properties in organic semiconductors: A theoretical investigation, Chin. Chem. Lett., 2021, 32, 3, 1233-1236.
8. YJ Sun, H Geng, Q Peng, ZG Shuai*, Computational Study on the Charge Transport and Optical Spectra of Anthracene Derivatives in Aggregates, ChemPhysChem, 2020, 21, 9, 952-957.
9. YJ Sun, ZG Shuai , and D Wang*, Reducing Lattice Thermal Conductivity of the Thermoelectric SnSe Monolayer: Role of Phonon–Electron Coupling，J. Phys. Chem. C, 2019, 123.
10. YJ Sun, ZG Shuai, D Wang*, Janus monolayer of WSeTe, a new structural phase transition material driven by electrostatic gating. Nanoscale, 2018,10, 21629.
11. YJ Sun, ZG Shuai, D Wang*, Lattice thermal conductivity of monolayer AsP from first-principles molecular dynamics, Phys. Chem. Chem. Phys, 2018, 20, 14024.
12. YJ Sun, D Wang* and ZG huai, Puckered Arsenene: A Promising Room-Temperature Thermoelectric Material from First-Principles Prediction. J. Phys. Chem. C, 2017, 121, 35.
13. TQ Zhao1, YJ Sun1, ZG Shuai, and D Wang*, GeAs2: A IV–V Group Two-Dimensional Semiconductor with Ultralow Thermal Conductivity and High Thermoelectric Efficiency. Chem. Mater, 2017, 29.
14. YJ Sun, D Wang*, and ZG Shuai*, Indirect-to-Direct Band Gap Crossover in Few-Layer Transition Metal Dichalcogenides: A Theoretical Prediction.” J. Phys. Chem. C, 2016, 120.
主持项目：
1. 低维体系热导率计算方法的第一性原理研究，天津大学自主创新基金（2021.01-2021.12）结题
2. 应变对有机小分子晶体发光及电荷传输性质调控机理的理论研究，国家自然科学基金青年项目（2021.01-2023.12）在研
3. 先进功能材料多尺度高效计算平台项目课题：有机光电材料高通量计算及其高精度数据库，信创海河实验室（2022.01-2024.12）在研
教学：
《物理化学3》
《物理化学实验》
《新能源材料与化学》（研究生）
招生：
欢迎化学、物理、材料等相关专业本科生加入进行科研或研究生深造。
炼丹专业的同学如果对化学、材料、能源等感兴趣也十分欢迎。
Experience
2022.04-Present Associate Professor, Tianjin University
2020.06-2022.03 Lecturer，Department of Chemistry, Tianjin University
2018.07-2020.06 Pre-hired Lecturer Department of Chemistry, Tianjin University
2014.09-2019.07 Ph.D. in Chemistry
Department of Chemistry, Tsinghua University (Supervisor: Prof. Zhigang Shuai)
2010.09- 2014.07 B.S. in Chemistry
Department of Chemistry and Chemical Engineering, Shandong University
