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Chemical Science|September 30, 2017
The photophysics of naphthalene dimers controlled by sulfur bridge oxidationClàudia Climent, Mario Barbatti, Michael O Wolf, et al.Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|September 4, 2015
Excited-State Proton Transfer Can Tune the Color of Protein Fluorescent MarkersDaiana T Mancini, Kakali Sen, Mario Barbatti, et al.The Journal of Physical Chemistry. A|April 4, 2020
Nonadiabatic Dynamics of Charge-Transfer States Using the Anthracene-Tetracyanoethylene Complex as a PrototypeFarhan Siddique, Mario Barbatti, Zhonghua Cui, et al.Journal of Chemical Theory and Computation|June 28, 2019
Ultrafast Photoinduced Dynamics of 1,3-Cyclohexadiene Using XMS-CASPT2 Surface HoppingIakov Polyak, Lewis Hutton, Rachel Crespo-Otero, et al.Journal of Chemical Theory and Computation|January 11, 2024
Recommendations for Velocity Adjustment in Surface HoppingJosene M Toldo, Rafael S Mattos, Max Pinheiro, et al.The Journal of Physical Chemistry. A|December 22, 2023
Auger-Meitner and X-ray Absorption Spectra of Ethylene Cation: Insight into Conical Intersection DynamicsBruno Nunes Cabral Tenorio, Jacob Pedersen, Mario Barbatti, et al.The Journal of Physical Chemistry Letters|September 22, 2023
Understanding the Impact of Symmetrical Substitution on the Photodynamics of Sinapate Esters Using Gas-Phase Ultrafast SpectroscopyJack Dalton, Josene M Toldo, Florent Allais, et al.The Journal of Chemical Physics|September 1, 2006
Automerization reaction of cyclobutadiene and its barrier height: an ab initio benchmark multireference average-quadratic coupled cluster studyMirjana Eckert-Maksić, Mario Vazdar, Mario Barbatti, et al.The Journal of Chemical Physics|December 20, 2012
Surface hopping dynamics using a locally diabatic formalism: charge transfer in the ethylene dimer cation and excited state dynamics in the 2-pyridone dimerFelix Plasser, Giovanni Granucci, Jiri Pittner, et al.Journal of Chemical Theory and Computation|December 14, 2016
Evaluation of Spin-Orbit Couplings with Linear-Response Time-Dependent Density Functional MethodsXing Gao, Shuming Bai, Daniele Fazzi, et al.Pageof 25