代表性论文
1. Lingyun Wan; Jie Liu*; Zhenyu Li; Jinlong Yang*; Hybrid Hamiltonian Simulation for Excitation Dynamics, The Journal of Physical Chemistry Letters, 15 (45) (2024), 11234-11243.
2. Yuhan Zheng; Zhijie Sun; Jie Liu*; Yi Fan; Zhenyu Li*; Jinlong Yang; Quantum Equation-of-Motion Method with Single, Double, and Triple Excitations, Journal of Chemical Theory and Computation, 20 (20) (2024), 9032-9040.
3. Qianjun Yao; Qun Ji; Xiaopeng Li; Yehui Zhang; Xinyu Chen; Ming-Gang Ju*; Jie Liu*; Jinlan Wang*; Machine Learning Accelerates Precise Excited-State Potential Energy Surface Calculations on a Quantum Computer, Journal of Physical Chemistry Letters, 15 (27) (2024), 7061–7068.
4. Honghui Shang#; Fei Wang#, Yi Fan#, Huan Ma, Qi Liu, Chu Guo, Pengyu Zhou, Qi Chen, Qian Xiao, Tianyu Zheng, Bin Li, Fen Zuo, Jie Liu*, Zhenyu Li, Jinlong Yang* , Large-scale quantum emulating simulations of biomolecules: A pilot exploration of parallel quantum computing, Science Bulletin, 69 (2024), 876-880.
5. Honghui Shang*; Yi Fan; Li Shen; Chu Guo*; Jie Liu*; Xiaohui Duan; Fang Li; Zhenyu Li; Towards practical and massively parallel quantum computing emulation for quantum chemistry, npj Quantum Information, 9 (2023), 33.
6. Huan Ma; Jie Liu*; Honghui Shang*; Yi Fan; Zhenyu Li; Jinlong Yang*; Multiscale quantum algorithms for quantum chemistry, Chemical Science, 14 (12) (2023), 3190-3205.
7. Yanxian Tao; Xiongzhi Zeng; Yi Fan; Jie Liu*; Zhenyu Li; Jinlong Yang*; Exploring accurate potential energy surfaces via integrating variational quantum eigensolver with machine learning, Journal of Physical Chemistry Letters, 13 (28) (2022), 6420-6426.
8. Jie Liu; Yi Fan; Zhenyu Li*; Jinlong Yang*; Quantum algorithms for electronic structures: basis sets and boundary conditions, Chemical Society Reviews, 51 (2022), 3263–3279.
9. Jie Liu; Zhenyu Li*; Jinlong Yang*; An efficient adaptive variational quantum solver of the Schrödinger equation based on reduced density matrices, Journal of Chemical Physics, 154 (24) (2021), 244112.
10. Jie Liu; Lingyun Wan; Zhenyu Li*; Jinlong Yang*; Simulating periodic systems on a quantum computer using molecular orbitals, Journal of Chemical Theory and Computation, 16 (11) (2020), 6904-6914.
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