Publication List
Papers In Preparation

Publication List

Prof. Xiao Zheng

    1. First-Principles Liouville-von Neumann Equation for Open Systems and its Applications, Koo Siu Kong, Yam Chi Yung, Zheng Xiao,and Chen GuanHua, Physica Status Solidi B-Basic Solid State Physics, 249(2), 270-275 (2012).
    2. Hierarchical Equations of Motion for Quantum Dissipation and Quantum Transport, X. Zheng, R. X. Xu, J. Xu, J. S. Jin, J. Hu, and Y. J. Yan, Prog. Chem. 24, 1129-52 (2012).
    3. Time-Dependent Quantum Transport: An Efficient Method Based on Liouville-von-Neumann Equation for Single-Electron Density Matrix, Hang Xie, Feng Jiang, Heng Tian, Xiao Zheng, Yanho Kwok, Shuguang Chen, ChiYung Yam, Y. J. Yan, and G. H. Chen, J. Chem. Phys. 137, 044113 (2012).
    4. Delocalization Error of Density-Functional Approximations: A Distinct Manifestation in Hydrogen Molecular Chains, Zheng Xiao, Liu Min, Johnson Erin R., Contreras-Garcia Julia, Yang Weitao, Journal of Chemical Physics, 137(21) (2012).
    5. Hierarchical Liouville-Space Approach for Accurate and Universal Characterization of Quantum Impurity Systems, Zhenhua Li, Ninghua Tong, Xiao Zheng, Dong Hou, Jianhua Wei, Jie Hu, and Y. J. Yan, Phys. Rev. Lett. 109, 266403 (2012).
    6. First-Principles Study on Structural and Chemical Asymmetry of a Biomimetic Water-Splitting Dimanganese Complex, Zhou Ting, Lin Xiangsong, Zheng Xiao, Journal of Chemical Theory and Computation, 9(2), 1073-1080 (2013).

Prof. RuiXue Xu

    1. Optimizing Hierarchical Equations of Motion for Quantum Dissipation and Quantifying Quantum Bath Effects on Quantum Transfer Mechanisms, Jin-Jin Ding, Rui-Xue Xu, and Y. J. Yan, J. Chem. Phys. 136, 224103 (2012).
    2. Hierarchical Equations of Motion Approach to Quantum Dissipation and Quantum Transport, Xiao Zheng, Rui-Xue Xu, Jian Xu, Jinshuang Jin, Jie Hu, and Y. J. Yan, Progress in Chemitry (Special Issue of Quantum Chemistry) 24 (6), 1129-1152 (2012).
    3. Experimental Study of Quantum Simulation for Quantum Chemistry with a Nuclear Magnetic Resonance Simulator, D. W. Lu, N. Y. Xu, B. R. Xu, Z. K. Li, H. W. Chen, X. H. Peng, R. X. Xu, and J. F. Du, Philos. Transact. R. Soc. A-Math. Phys. & Eng. Sci. 370, 4734-47 (2012).
    4. Quantum Chemistry Simulation on Quantum Computers: Theories and Experiments, D. W. Lu, B. R. Xu, N. Y. Xu, Z. K. Li, H. W. Chen, X. H. Peng, R. X. Xu, and J. F. Du, Phys. Chem. Chem. Phys. 14, 9411-20 (2012).
    5. Correlated Driving and Dissipation in Two-Dimensional Spectroscopy, Jian Xu, Houdao Zhang, Rui-Xue Xu, and Y. J. Yan, J. Chem. Phys. 138, 024106 (2013).

Prof. YiJing Yan

    1. Langevin Dynamics of Correlated Subdiffusion and Normal Diffusion, YingXi Wang, NanRong Zhao, and Y. J. Yan, Phys. Rev. E 85, 041142 (2012).
    2. Optimizing Hierarchical Equations of Motion for Quantum Dissipation and Quantifying Quantum Bath Effects on Quantum Transfer Mechanisms, Jin-Jin Ding, Rui-Xue Xu, and Y. J. Yan, J. Chem. Phys. 136, 224103 (2012).
    3. Inelastic Electron Transport through Mesoscopic Systems: Heating versus Cooling and Sequential Tunneling versus Cotunneling Processes, Feng Jiang, J. S. Jin, ShiKuan Wang, and Y. J. Yan, Phys. Rev. B 85, 245427 (2012).
    4. Hierarchical Equations of Motion Approach to Quantum Dissipation and Quantum Transport, Xiao Zheng, Rui-Xue Xu, Jian Xu, Jinshuang Jin, Jie Hu, and Y. J. Yan, Progress in Chemitry (Special Issue of Quantum Chemistry) 24 (6), 1129-1152 (2012).
    5. Time-Dependent Quantum Transport: An Efficient Method Based on Liouville-von-Neumann Equation for Single-Electron Density Matrix, Hang Xie, Feng Jiang, Heng Tian, Xiao Zheng, Yanho Kwok, Shuguang Chen, ChiYung Yam, Y. J. Yan, and G. H. Chen, J. Chem. Phys. 137, 044113 (2012).
    6. Force Field Development for Cofactors in the Photosystem II, Lu Zhang, Daniel-Adriano Silva, Y. J. Yan, and Xuhui Huang, J. Comput. Chem. 33 (25), 1969-1980 (2012).
    7. Hierarchical Liouville-Space Approach for Accurate and Universal Characterization of Quantum Impurity Systems, Zhenhua Li, Ninghua Tong, Xiao Zheng, Dong Hou, Jianhua Wei, Jie Hu, and Y. J. Yan, Phys. Rev. Lett. 109, 266403 (2012).
    8. Correlated Driving and Dissipation in Two-Dimensional Spectroscopy, Jian Xu, Houdao Zhang, Rui-Xue Xu, and Y. J. Yan, J. Chem. Phys. 138, 024106 (2013).
    9. Undetectable Quantum Transfer through a Continuum, Jing Ping, Yin Ye, Luting Xu, Xin-Qi Li, YiJing Yan, and Shmuel Gurvitz, Phys. Lett. A 377, 676-681 (2013).

Papers In Preparation

Including:

    1. Quantum Dynamics in Dissipative Molecular Systems, Houdao Zhang, Jian Xu, Rui-Xue Xu, and Y. J. Yan, Adv. Multi-Photon Processes and Spectros. 21 (2013).
    2. Hierarchical Liouville-Space Approach to Nonequilibrium Dynamic Properties of Quantum Impurity Systems, ShiKuan Wang, X. Zheng, J. S. Jin, and Y. J. Yan, Phys. Rev. B (2013).