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李振东,男,博士,北京师范大学化学学院教授 。主要研究方向:高精度电子结构理论;量子化学算法和程序开发(并行计算、量子计算)
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李振东
教授,理学博士(北京大学)
通信地址:北京市新街口外大街19号,北京师范大学化学学院
邮编:100875
电子邮箱:zhendongli@bnu.edu.cn
教育和工作经历
2005年-2009年:北京大学,材料化学,数学与应用数学(双学位),理学学士
2009年-2014年:北京大学,物理化学,理学博士(导师:刘文剑教授)
2014年-2016年:普林斯顿大学,博士后(合作导师:Garnet K.-L. Chan教授)
2016年-2018年:加州理工学院,博士后(合作导师:Garnet K.-L. Chan教授)
2019年-至今:北京师范大学化学学院,教授
研究兴趣
高精度电子结构理论;量子化学算法和程序开发(并行计算、量子计算)
招聘信息
对理论化学、量子物理、高性能计算等方向感兴趣的本科生、博士、博士后
代表性论文
- Zhendong Li*, Sheng Guo, Qiming Sun, and Garnet Kin-Lic Chan*, The electronic landscape of the P-cluster of nitrogenase, arXiv:1810.10196.
- Chuhuan He, Zhendong Li*, Yibo Lei, Wenli Zou, and Bingbing Suo*, Unraveling the emission mechanism of radical-based organic light-emitting diodes, J. Phys. Chem. Lett., 10, 574 (2019).
- Zhendong Li, Junhao Li, Nikesh S. Dattani, C. J. Umrigar, and Garnet Kin-Lic Chan*, The electronic complexity of the ground-state of the FeMo cofactor of nitrogenase as relevant to quantum simulations, J. Chem. Phys. 150, 024302 (2019).
- Matthew J. O’Rourke, Zhendong Li, and Garnet Kin-Lic Chan*, Efficient representation of long-range interactions in projected entangled-pair operators, Phys. Rev. B 98, 205127 (2018).
- Zhendong Li* and Garnet Kin-Lic Chan*, Spin-projected matrix product states: versatile tool for strongly correlated systems, J. Chem. Theory Comput. 13, 2681 (2017).
- Zhendong Li* and Garnet Kin-Lic Chan*, Hilbert space renormalization for the many-electron problem, J. Chem. Phys. 144, 084103 (2016).
- Zhendong Li*, Sihong Shao*, and Wenjian Liu*, Classifications and canonical forms of tensor product expressions in the presence of permutation symmetries, arXiv:1604.06156.
- Zhendong Li* and Wenjian Liu*, Critical Assessment of TD-DFT for Excited States of Open-Shell Systems: I. Doublet–Doublet Transitions, J. Chem. Theory Comput. 12, 238 (2016).
- Zhendong Li and Wenjian Liu*, First-order nonadiabatic coupling matrix elements between excited states: A Lagrangian formulation at the CIS, RPA, TD-HF, and TDDFT levels, J. Chem. Phys. 141, 014110 (2014). (JCP Editor’s Choice for 2014)
- Zhendong Li, Bingbing Suo, Yong Zhang, Yunlong Xiao, and Wenjian Liu*, Combining spin-adapted open-shell TD-DFT with spin-orbit coupling, Mol. Phys. 111, 3741 (2013).
- Zhendong Li, Yunlong Xiao, and Wenjian Liu*, On the spin separation of algebraic two-component relativistic Hamiltonians, J. Chem. Phys. 137, 154114 (2012).
- Zhendong Li (co-first author), Sihong Shao (co-first author), and Wenjian Liu*, Relativistic explicit correlation: Coalescence conditions and practical suggestions, J. Chem. Phys. 136, 144117 (2012).
- Zhendong Li and Wenjian Liu*, Spin-adapted open-shell time-dependent density functional theory. III. An even better and simpler formulation, J. Chem. Phys. 135, 194106 (2011).
- Zhendong Li, Wenjian Liu*, Yong Zhang, and Bingbing Suo, Spin-adapted open-shell time-dependent density functional theory. II. Theory and pilot application, J. Chem. Phys. 134, 134101 (2011).
- Zhendong Li and Wenjian Liu*, Spin-adapted open-shell random phase approximation and time-dependent density functional theory. I. Theory, J. Chem. Phys. 133, 064106 (2010).
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