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The 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 LiangThe Journal of Chemical Physics|July 13, 2011
Analytical Hessian of electronic excited states in time-dependent density functional theory with Tamm-Dancoff approximationJie Liu, WanZhen LiangChemical Society Reviews|November 23, 2011
Charge transfer in organic molecules for solar cells: theoretical perspectiveYi Zhao, WanZhen LiangThe Journal of Physical Chemistry Letters|March 17, 2017
How the Structures and Properties of Two-Dimensional Layered Perovskites MAPbI3 and CsPbI3 Vary with the Number of LayersLei Zhang, WanZhen LiangJournal of Chemical Theory and Computation|August 16, 2022
Amplitude Reordering Accelerates the Adaptive Variational Quantum Eigensolver AlgorithmsZhihao Lan, WanZhen LiangThe Journal of Chemical Physics|August 3, 2011
Theoretical investigation of resonance Raman scattering of dye molecules absorbed on semiconductor surfacesYi Zhao, WanZhen LiangACS Omega|August 29, 2019
NB-Type Electronic Asymmetric Compounds as Potential Blue-Color TADF Emitters: Steric Hindrance, Substitution Effect, and Electronic CharacteristicsChunyun Tu, WanZhen LiangThe Journal of Chemical Physics|January 10, 2020
The vibronic absorption spectra and exciton dynamics of plasmon-exciton hybrid systems in the regimes ranged from Fano antiresonance to Rabi-like splittingBin Zhang, WanZhen LiangPageof 9