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The Journal of Physical Chemistry. B|August 20, 2008
Anomalously increased lifetimes of biological complexes at zero force due to the protein-water interfaceYuriy V Pereverzev, Oleg V Prezhdo, Evgeni V SokurenkoACS Nano|February 12, 2009
Breaking the phonon bottleneck in PbSe and CdSe quantum dots: time-domain density functional theory of charge carrier relaxationSvetlana V Kilina, Dmitri S Kilin, Oleg V PrezhdoJournal of the American Chemical Society|June 21, 2007
Time-domain ab initio study of charge relaxation and recombination in dye-sensitized TiO2Walter R Duncan, Colleen F Craig, Oleg V PrezhdoJournal of the American Chemical Society|September 29, 2009
Ab initio nonadiabatic molecular dynamics of wet-electrons on the TiO(2) surfaceSean A Fischer, Walter R Duncan, Oleg V PrezhdoThe Journal of Physical Chemistry Letters|August 18, 2015
Exploding Nitromethane in Silico, in Real TimeEudes Eterno Fileti, Vitaly V Chaban, Oleg V PrezhdoThe Journal of Physical Chemistry Letters|August 21, 2015
Covalent Linking Greatly Enhances Photoinduced Electron Transfer in Fullerene-Quantum Dot Nanocomposites: Time-Domain Ab Initio StudyVitaly V Chaban, Victor V Prezhdo, Oleg V PrezhdoThe Journal of Physical Chemistry Letters|March 17, 2023
Strong Bending Distortion of a Supercoronene Graphene Model upon Adsorption of Lanthanide AtomsElena V Basiuk, Oleg V Prezhdo, Vladimir A BasiukJournal of Chemical Theory and Computation|June 26, 2025
Basis-Discretized Surface Hopping for Auger ProcessesXuhui Xu, Shriya Gumber, Oleg V Prezhdo, et al.Journal of the American Chemical Society|January 29, 2025
Atomistic Origin of Microsecond Carrier Lifetimes at Perovskite Grain Boundaries: Machine Learning-Assisted Nonadiabatic Molecular DynamicsYifan Wu, Weibin Chu, Bipeng Wang, et al.The Journal of Physical Chemistry Letters|August 18, 2015
Control of Carbon Nanotube Electronic Properties by Lithium Cation IntercalationOleksandr M Korsun, Oleg N Kalugin, Oleg V PrezhdoPageof 56