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The Journal of Physical Chemistry. A|December 21, 2020
Improving the Accuracy of Quasiclassical Mapping Hamiltonian Methods by Treating the Window Function Width as an Adjustable ParameterXing Gao, Eitan GevaJournal of Chemical Theory and Computation|September 1, 2020
A Nonperturbative Methodology for Simulating Multidimensional Spectra of Multiexcitonic Molecular Systems via Quasiclassical Mapping Hamiltonian MethodsXing Gao, Eitan GevaJournal of Chemical Theory and Computation|September 3, 2020
Simulating Absorption Spectra of Multiexcitonic Systems via Quasiclassical Mapping Hamiltonian MethodsXing Gao, Yifan Lai, Eitan GevaJournal of Chemical Theory and Computation|May 19, 2020
Electronic Dynamics through Conical Intersections via Quasiclassical Mapping Hamiltonian MethodsYudan Liu, Xing Gao, Yifan Lai, et al.The Journal of Chemical Physics|August 24, 2019
Combining the mapping Hamiltonian linearized semiclassical approach with the generalized quantum master equation to simulate electronically nonadiabatic molecular dynamicsEllen Mulvihill, Xing Gao, Yudan Liu, et al.The Journal of Chemical Physics|August 6, 2020
Charge transfer rate constants for the carotenoid-porphyrin-C<sub>60</sub> molecular triad dissolved in tetrahydrofuran: The spin-boson model vs the linearized semiclassical approximationZhengqing Tong, Xing Gao, Margaret S Cheung, et al.The Journal of Chemical Physics|July 9, 2021
Simulating energy transfer dynamics in the Fenna-Matthews-Olson complex via the modified generalized quantum master equationEllen Mulvihill, Kristina M Lenn, Xing Gao, et al.Journal of Chemical Theory and Computation|April 2, 2020
Benchmarking Quasiclassical Mapping Hamiltonian Methods for Simulating Electronically Nonadiabatic Molecular DynamicsXing Gao, Maximilian A C Saller, Yudan Liu, et al.The Journal of Physical Chemistry. B|January 31, 2012
Mixed quantum-classical molecular dynamics study of the hydroxyl stretch in methanol/carbon-tetrachloride mixtures II: excited state hydrogen bonding structure and dynamics, infrared emission spectrum, and excited state lifetimeKijeong Kwac, Eitan GevaThe Journal of Chemical Physics|July 24, 2009
A self-consistent treatment of electron transfer in the limit of strong friction via the mixed quantum classical Liouville methodQiang Shi, Eitan GevaPageof 94