李振东 - 北京师范大学

个人简介

教授，博士生导师，理学博士（北京大学），博士后（美国普林斯顿大学、加州理工学院）讲授课程化学测量与计算实验I，高等量子化学，中级物理化学

研究领域

高精度电子结构理论（张量网络态、相对论量子化学、激发态）量子化学算法和程序开发（并行计算、量子计算）

近期论文

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X. Cai, W.-H. Fang, H. Fan, and Z. Li*, Quantum computation of molecular response properties, Phys. Rev. Res. 2, 033324 (2020). Z. Li*, “Stochastic many-body perturbation theory for electron correlation”, J. Chem. Phys. 151, 244144 (2019). C. He, Z. Li*, Y. Lei, W. Zou, and B. Suo*, “Unraveling the emission mechanism of radical-based organic light-emitting diodes”, J. Phys. Chem. Lett., 10, 574 (2019). D. Cho*, J. R. Rouxel, S. Mukamel*, G. K.-L. Chan*, and Z. Li*, “Stimulated X-ray Raman and Absorption Spectroscopy of Iron–Sulfur Dimers”, J. Phys. Chem. Lett. 10, 6664 (2019). Z. Li*, S. Guo, Q. Sun, and G. K.-L. Chan*, “Electronic landscape of the P-cluster of nitrogenase as revealed through many-electron quantum wavefunction simulations”, Nat. Chem. 11, 1026 (2019). Z. Li*, M. J. O’Rourke, and G. K.-L. Chan*, “Generalization of the exponential basis for tensor network representations of long-range interactions in two and three dimensions”, Phys. Rev. B 100, 155121 (2019). Z. Li, J. Li, N. S. Dattani, C. J. Umrigar, and G. K.-L. 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). M. J. O’Rourke, Z. Li, and G. K.-L. Chan*, “Efficient representation of long-range interactions in projected entangled-pair operators”, Phys. Rev. B 98, 205127 (2018). G. Guo, Z. Li, and G. K.-L. Chan*, “An efficient stochastic algorithm for the perturbative density matrix renormalization group”, J. Chem. Phys. 148, 221104 (2018). S. Guo, Z. Li, and G. K.-L. Chan*, “A perturbative density matrix renormalization group algorithm for large active spaces”, J. Chem. Theory Comput. 14, 4063 (2018). Z. Li* and G. K.-Lic Chan*, “Spin-projected matrix product states: versatile tool for strongly correlated systems”, J. Chem. Theory Comput. 13, 2681 (2017).