谢默
2010-2015 吉林大学，理论化学研究所，博士（硕博连读）
2006-2010 东北师范大学，化学学院，学士
· 工作经历
2022至今 暨南大学，化学与材料学院，副教授
2018-2021 暨南大学，化学与材料学院，博士后
2015-2018 南方科技大学/武汉大学，博士后
· 研究方向
1.功能配位超分子的分子设计及性质调控
2.配位超分子体系中的非共价相互作用理论研究
3.配位超分子体系的理论计算方法研究，高通量筛选，机器学习等
· 承担课题
1.国家自然科学基金，青年项目，具有压力响应的环三核金属配合物的设计合成及发光性质研究，2022-01至2024-12，主持
· 讲授课程
基础量子化学；超分子配位化学
· 发表论文
(1) Xie, Mo; Chen, Xiao-Ru; Wu, Kun; Lu, Zhou; Wang, Kai; Li, Nan; Wei, Rong-Jia; Zhan, Shun-Ze; Ning, Guo-Hong*; Zou, Bo*; Li, Dan*.Pressure-induced phosphorescence enhancement and piezochromism of a carbazole-based cyclic trinuclear Cu(i) complex. Chem. Sci.2021, 12, 4425-4431.
(2) Wu, Yao#; Xie, Mo#; Jin, Ji-Kang; Zhang, Zhi-Yin; Hu, Han; Tian, You-Ping; Xiao, Yu-Qing; Ning, Guo-Hong*; Li, Dan*; Jiang, Xuanfeng*. A Copper Iodide Cluster-Based Metal–Organic Polyhedra for Photocatalytic Click Chemistry. Small Struct. 2021, 2100155.
(3) Xie, Mo*; Lu, Wei*.Theoretical insights into intermolecular interactions during d8 organometallic self-aggregation. Dalton Trans.2019, 48, 1275-1283.
(4) Xie, Mo*; Lu, Wei*. Attraction or repulsion? Theoretical assessment of bulky alkyl groups by employing dispersion-corrected DFT. RSC Adv.2018, 8, 2240-2247.
(5) Xie, Mo; Bai, Fu-Quan*; Wang, Jian; Kong, Chui-Peng; Chen, Jie; Zhang, Hong-Xing*.Theoretical description of dye regeneration on the TiO2–dye–electrolyte model. Comput. Mater. Sci.2016, 111, 239-246.
(6) Xie, Mo; Wang, Jian; Bai, Fu-Quan*; Hao, Li; Zhang, Hong-Xing*.Discovering the intermediate of dye regeneration in dye-sensitized solar cells: Theoretical investigations on the interaction between organic dye with different donors and (X= I, Br). Dyes Pigm.2015, 120, 74-84.
(7) Xie, Mo; Chen, Jie; Bai, Fu-Quan*; Wei, Wei; Zhang, Hong-Xing*.Theoretical Studies on the Interaction of Ruthenium Sensitizers and Redox Couple in Different Deprotonation Situations. J. Phys. Chem. A2014, 118, 2244-2252.
(8) Xie, Xiao-Jing; Zeng, Heng; Xie, Mo; Chen, Wei; Hua, Gui-Fang; Lu, Weigang*; Li, Dan*. A metal-organic framework for C2H2/CO2 separation under highly humid conditions: Balanced hydrophilicity/hydrophobicity. Chem. Eng. J.2022, 427, 132033.
(9) Zeng, Heng; Xie, Mo; Wang, Ting; Wei, Rong-Jia; Xie, Xiao-Jing; Zhao, Yifang; Lu, Weigang*; Li, Dan*. Orthogonal-array dynamic molecular sieving of propylene/propane mixtures. Nature2021, 595, 542-548.
(10) Yan, Jie; Cui, Yutao; Xie, Mo; Yang, Guo-Zhan; Bin, De-Shan*; Li, Dan*. Immobilizing Redox-Active Tricycloquinazoline into a 2D Conductive Metal–Organic Framework for Lithium Storage. Angew. Chem. Int. Ed.2021, 60, 24467-24472.
(11) Duan, Haiyan; Li, Ke; Xie, Mo; Chen, Jia-Ming; Zhou, Hou-Gan; Wu, Xiaofeng; Ning, Guo-Hong*; Cooper, Andrew I.*; Li, Dan*. Scalable Synthesis of Ultrathin Polyimide Covalent Organic Framework Nanosheets for High-Performance Lithium–Sulfur Batteries. J. Am. Chem. Soc.2021, 143, 19446-19453.
(12) Zeng, Heng; Xie, Mo; Huang, Yong-Liang; Zhao, Yifang; Xie, Xiao-Jing; Bai, Jian-Ping; Wan, Meng-Yan; Krishna, Rajamani; Lu, Weigang*; Li, Dan*. Induced Fit of C2H2 in a Flexible MOF Through Cooperative Action of Open Metal Sites. Angew. Chem. Int. Ed.2019, 58, 8515-8519.
(13) Ke, Hua; Yang, Liu-Pan; Xie, Mo; Chen, Zhao; Yao, Huan; Jiang, Wei*. Shear-induced assembly of a transient yet highly stretchable hydrogel based on pseudopolyrotaxanes. Nat. Chem.2019, 11, 470.
(14) Zeng, Heng; Xie, Xiao-Jing; Xie, Mo; Huang, Yong-Liang; Luo, Dong; Wang, Ting; Zhao, Yifang; Lu, Weigang*; Li, Dan*. Cage-Interconnected Metal–Organic Framework with Tailored Apertures for Efficient C2H6/C2H4 Separation under Humid Conditions. J. Am. Chem. Soc.2019, 141, 20390-20396.
(15) Jin, Ji-Kang; Wu, Kun; Liu, Xin-Yi; Huang, Guo-Quan; Huang, Yong-Liang; Luo, Dong; Xie, Mo; Zhao, Yifang; Lu, Weigang*; Zhou, Xiao-Ping*; He, Jian*; Li, Dan*. Building a Pyrazole–Benzothiadiazole–Pyrazole Photosensitizer into Metal–Organic Frameworks for Photocatalytic Aerobic Oxidation. J. Am. Chem. Soc.2021, 143, 21340-21349.
(16) Peng, Su-Kao; Lu, Zhou; Xie, Mo; Huang, Yong-Liang; Luo, Dong; Wang, Jia-Nan; Zhu, Xiao-Wei; Li, Xue; Zhou, Xiao-Ping*; Li, Dan*. Unexpected structural transformation into noria-like Ag13 metal clusters and a copper-doping induced boost in photoluminescence. Chem. Commun.2020, 56, 4789-4792.
(17) Bai, Jian-Ping; Huang, Yong-Liang; Xie, Mo; Zhao, Yifang; Luo, Dong; Li, Yan Yan; Lu, Weigang*; Li, Dan*. Reversible Multiphase Transition in a BioMOF and Its Distinctive Luminescence Turn-On in Alcohol Vapor. ACS Appl. Mater. Interfaces2019, 11, 38503-38509.
(18) Zheng, Ji; Yang, Hu; Xie, Mo; Li, Dan*. The π-acidity/basicity of cyclic trinuclear units (CTUs): from a theoretical perspective to potential applications. Chem. Commun.2019, 55, 7134-7146.
