97 citations · 519 across the 23 of their papers we have counts for
4 papers · 1 filter
A Further Comparison of MPS and TTNS for Nonadiabatic Dynamics of Exciton Dissociation
Weitang Li, Jiajun Ren, Jun Yan
Tensor networks, such as matrix product states (MPS) and tree tensor network states (TTNS), are powerful ansätze for simulating quantum dynamics. While both ansätze are theoretical…
Quantum-Classical Hybrid Computation of Electron Transfer in a Cryptochrome Protein via VQE-PDFT and Multiscale Modeling
Yibo Chen, Zirui Sheng, Weitang Li +4
Accurate calculation of strongly correlated electronic systems requires proper treatment of both static and dynamic correlations, which remains challenging for conventional methods…
Multi-set variational quantum dynamics algorithm for simulating nonadiabatic dynamics on quantum computers
Jingjing Li, Weitang Li, Xiaoxiao Xiao +4
Accelerating quantum dynamical simulations with quantum computing has received considerable attention but remains a significant challenge. In variational quantum algorithms for qua…
Quantum Machine Learning of Molecular Energies with Hybrid Quantum-Neural Wavefunction
Weitang Li, Shi-Xin Zhang, Zirui Sheng +3
Quantum computational chemistry holds great promise for simulating molecular systems more efficiently than classical methods by leveraging quantum bits to represent molecular wavef…