刘小锐

副教授，理学博士，博士后，硕士研究生导师。

个人简介

1988年1月出生，重庆彭水人，2010年9月至2015年6月在西南大学物理化学专业攻读博士学位（直博），导师是李明教授；2015年7月至2017年7月在西南大学药学院从事师资博士后研究工作，合作导师是黄承志教授；2017年8月至今，在西南大学化学化工学院从事教学科研工作，主讲《物理化学》和《理化测试》等课程；2018年7月晋升为副教授，2019年12月被聘为硕士研究生导师。主要从事计算化学、有机功能材料模拟与应用及钙钛矿太阳能电池器件等研究工作，主持国家自然科学基金、重庆市自然科学基金、等多项。以第一作者或通讯作者在Adv. Funct. Mater.、J. Mater. Chem. A、J. Mater. Chem. C、Appl. Surf. Sci., Phys. Chem. Chem. Phys.、J. Phys. Chem. C、J. Power Sources等上面发表学术论文40余篇。科研成果获2019年度重庆市科学技术奖（自然科学）三等奖。

联系方式

邮箱：liuxiaorui@swu.edu.cn

地址：重庆市北碚区天生路2号西南大学半月楼

研究方向

计算化学、有机功能材料模拟与应用、钙钛矿太阳能电池器件

主持项目：

1.成都市科学技术局重点研发项目（2023-YF11-00027-HZ），2024/01-2025/12.

2.国家自然科学基金青年基金（21803043），2019/01-2021/12.

3.重庆市自然科学基金面上项目（cstc2020jcyj-msxmX0379），2020/07-2023/06.

4.西南大学人才引进基金(SWU117050)，2018/01-2019/12.

5.中国博士后科学基金（2016M592618），2016/06-2017/06.

近三年发表的部分论文：

1.Jiayi Qi, Ruiqin Wang, Xin Chen, Fei Wu,^*Wei Shen, Ming Li, Rongxing He,^*Xiaorui Liu^*. Modulation of intermolecular interactions in hole transporting materials for improvement of perovskite solar cell efficiency: a strategy of trifluoromethoxy isomerization.J. Mater. Chem. A,2024, 12, 4067-4076.

2.Ruiqin Wang, Chengyu Wu, Jiayi Qi, Wei Shen, Fei Wu,^*Ming Li, Rongxing He,^*Xiaorui Liu^*. Side-chain methylthio-based position isomerism of hole-transport materials for perovskite solar cells: from theoretical simulation to experimental characterization.Adv. Funct. Mater.,2023, 33, 2213843.

3.Chengyu Wu, Ruiqin Wang, Jiayi Qi, Xin Chen, Fei Wu,^*Xiaorui Liu^*. Theoretical calculations and experimental investigation toward the π-conjugated modulation in arylamine derivative-based hole transporting materials for perovskite solar cells.Phys. Chem. Chem. Phys.,2023, 25, 27151-27160.

4.Ruiqin Wang, RuiWang, Xin Chen, Chengyu Wu, Fei Wu,^*Xiaorui Liu^*.Side-chain engineering on triphenylamine derivative-based hole-transport materials for perovskite solar cells: Theoretical simulation and experimental exploration.Dyes Pigm.,2023, 212, 111097.

5. Ruiqin Wang, Xin Chen, Chengyu Wu, Jiayi Qi, Xin Jiang, Fei Wu,^*Xiaorui Liu^*.Methoxy management of side chains on the carbazole-diphenylamine derivatives based hole transport materials for perovskite solar cells: A theoretical design and experimental research.Appl. Surf. Sci.,2023, 639, 158192.

6. Jingwei Zhang, Jingfu Chen, Fei Wu,^*Guimei Huang,Xiaorui Liu,^*Rongxing He,^*and Linna Zhu^*. Azobenzene-Phenazine-Based D-A Polymer as a Highly Efficient Bipolar Cathode for Sodium-Ion Batteries.ACS Sustainable Chem. Eng.2023, 11, 50, 17849–17856.

7. Hongyuan Liu, Hao Sun, Qian Chen, Fei Wu,^*Xiaorui Liu^*. Two simple hole-transporting materials for perovskite solar cells: A DFT calculation and experimental study.Appl. Surf. Sci.,2022, 604, 154603.

8.Qian Chen, Hongyuan Liu, Ruiqin Wang, Chengyu Wu, Fei Wu,^*Xing Liu,^*Xiaorui Liu^*. Peripheral group engineering on hole-transporting materials in perovskite solar cells: Theoretical design and experimental research.Dyes Pigm.,2022, 206, 110604.

9. Hongyuan Liu, Qian Chen, Fei Wu*, andXiaorui Liu^*. Pyrene core-based dopant-free hole transporting materials for perovskite solar cells: a theoretical design and experimental verification.J. Phys. Chem. C,2022, 126, 160-168.

10. Jingwei Zhang, Kangkang Jia, Xiaoxue Li,Xiaorui Liu,^*Linna Zhu^*and Fei Wu^*. A furan-based organic cathode material for highperformance sodium ion batteries.J. Mater. Chem. A,2022, 10, 10062–10068.