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Wenjian Liu
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Professor Supervisor of Doctorate Candidates Supervisor of Master's Candidates
Paper Publications
[1] X. Wang, J. Jin, C. Chen, Z. Wang*, Y. Lei*, X. Huang*, Y. Guo*, and W. Liu,
Mechanistic understanding of room temperature phosphorescence in pure organic host–guest systems...,
J. Mater. Chem. C 2025, DOI: 10.1039/d5tc03334a.
[2] X. Bai, Y. Wang, W. Yang, Q. Xu*, and W. Liu,
Magnetic topological Weyl fermions in half-metallic In2CoSe4,
J. Phys.: Condens. Matter 2025, 37, 115701.
[3] Y. Liu, R. Wang, H. Wang*, and W. Liu,
Unbinding Dynamics of Large HIV Non-Nucleoside Reverse Transcriptase Inhibitors Revealed by Atomi...,
J. Phys. Chem. B 2025, https://doi.org/10.1021/acs.jpcb.5c04843.
[4] B. Wang, S. Luo, Z. Wang*, and W. Liu*,
O1NumHess: A Fast and Accurate Seminumerical Hessian Algorithm Using Only O(1) Gradients,
J. Chem. Theory Comput. 2025, 21, 10893−10909.
[5] H. Liu, S. Guan, Z. Wang, Z. Zhou*, Z. Qu*, and W. Liu*,
Machine Learned Fock Matrix,
JACS Au 2025, 5, 5698-5706.
[6] B. Wang, X. Liu, Z. L. Wang*, C. Wu*, Z. K. Wang*, and W. Liu,
Structural Origin of the Fast Polymerization Rates and Monomer Universality of Pyrazole-Based Pho...,
Molecules 2025, 30, 3687.
[7] N. Zhang, Q. Wang, and W. Liu*,
MetaWave:A Platform for Unified Implementation of Nonrelativistic and Relativistic Wave Functions,
J. Phys. Chem. A 2025, 129, 5170-5188.
[8] Y. Wang, W. Yang, W. Shi, W. Liu*, and Q. Xu*,
Exhaustive screening of high-fold degenerate topological semimetal with chiral structure,
npj Computational Materials 2025, 11, 120.
[9] X. He, W. Liu*, and S. Liu*,
Using Energetic Information Quantities from Density Functional Theory to Simultaneously Identify...,
ChemPhysChem 2025, 26, 10.1002/cphc.202401068.
[10] X. Ji, H. Wang*, and W. Liu,
Experiment-Guided Refinement of Milestoning Network,
J. Chem. Theory Comput. 2025, 21, 1078-1088.
TOTAL 178 PIECE 1/18
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