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Journal of Chemical Theory and Computation|November 26, 2024
Integrating Self-Initialized Local Thermalizing Lindblad Operators for Variational Quantum Algorithm with Quantum Jump: Implementation and PerformanceZhihao Lan, WanZhen LiangJournal of Chemical Theory and Computation|August 16, 2022
Amplitude Reordering Accelerates the Adaptive Variational Quantum Eigensolver AlgorithmsZhihao Lan, WanZhen LiangThe Journal of Physical Chemistry Letters|June 1, 2026
Extracting Transfer Tensors from Stochastic Schrödinger Equation Trajectories: A Novel Approach to Dissipative Quantum DynamicsSiyuan Gao, Zhihao Lan, WanZhen Liang, et al.The Journal of Chemical Physics|October 9, 2025
Variational quantum simulation of time-local quantum master equations via quantum jumpZhihao Lan, Jie Liu, Zhenyu Li, et al.The Journal of Chemical Physics|October 10, 2015
Analytic energy gradient of excited electronic state within TDDFT/MMpol framework: Benchmark tests and parallel implementationQiao Zeng, WanZhen LiangThe Journal of Chemical Physics|January 9, 2025
Analytical derivative approaches for vibro-polaritonic structures and properties. I. Formalism and implementationXunkun Huang, WanZhen LiangThe Journal of Physical Chemistry Letters|November 23, 2020
How the Structures and Properties of Pristine and Anion Vacancy Defective Organic-Inorganic Hybrid Double Perovskites MA2AgIn(BrI1-)6 Vary with Br Content xQi Liu, WanZhen LiangThe Journal of Chemical Physics|November 18, 2011
Analytical approach for the excited-state Hessian in time-dependent density functional theory: formalism, implementation, and performanceJie Liu, WanZhen LiangThe Journal of Chemical Physics|January 17, 2013
Analytical second derivatives of excited-state energy within the time-dependent density functional theory coupled with a conductor-like polarizable continuum modelJie Liu, WanZhen LiangThe Journal of Chemical Physics|January 29, 2009
Non-Condon nature of fluctuating bridges on nonadiabatic electron transfer: analytical interpretationYi Zhao, Wanzhen LiangPageof 12