Weihai Fang

187PUBLICATIONS
118CO-AUTHORS
Theoretical quantum chemistryNonlinear optics and spectroscopyCondensed matter modelling and density functional theoryNanoelectromechanical systemsMolecular and organic electronics
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Publications (187)

|Oct 23, 2026
Extrapolating Molecular Correlation Energies to the Complete Basis Set Limit with Symbolic Regression.

|Oct 23, 2026
Probing Unusual Intrinsic Photophysical Properties of Thiocoumarin from XMS-CASPT2 Calculations.

|Oct 23, 2026
Clifford Disentanglers for Entanglement Reduction in Molecular Electronic Structure Simulations.

|Oct 23, 2026
Domain-Wall-Mediated Ultralow-Barrier Sliding and Pinning in Ferroelectric Moiré Superlattices Revealed by Machine Learning.

|Sep 01, 2026
Temperature-Selected Defect-Moiré Coupling Controls Nonradiative Charge Recombination in Twisted MoS2.

|Jul 27, 2026
Ancillary Ligand-Controlled Dinitrogen Cleavage and Transformation at Titanium Centers.

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Frequent Collaborators

53 joint publications

Run Long

46 joint publications

Ganglong Cui

26 joint publications

Oleg V Prezhdo

20 joint publications

Lin Shen