Oleg Prezhdo

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Vitaly ChabanDeveloper; Сhemist; ProfessorVerified email at edu.pucrs.br
Weibin ChuFudan UniversityVerified email at usc.edu
Walter DuncanSchrodingerVerified email at schrodinger.com
Svetlana V KilinaAssistant professor chemistry North Dakota State UniversityVerified email at ndsu.edu
Amanda NeukirchLos Alamos National LaboratroyVerified email at lanl.gov
Bradley F HabenichtPost Doctoral Research Assistant, Oak Ridge National LaboratoryVerified email at ornl.gov
Dmitri KilinNorth Dakota State University; University of South DakotaVerified email at ndsu.edu
Andrey S. VasenkoProfessor, HSE UniversityVerified email at hse.ru
Wissam A. SaidiUniversity of Pittsburgh; Mechanical Engineering and Materials ScienceVerified email at pitt.edu
Linqiu LiuscVerified email at usc.edu
Sergei TretiakLos Alamos National LaboratoryVerified email at lanl.gov
郑奇靖 | Qijing ZhengUniversity of Science and Technology of ChinaVerified email at ustc.edu.cn
Linjun WangUniversity of Sourthern CaliforniaVerified email at usc.edu
Dhara TrivediAssistant Professor, Clarkson UniversityVerified email at clarkson.edu
Jin LiuUniversity of RochesterVerified email at hse.rochester.edu
Zhi-Heng LohNanyang Technological UniversityVerified email at ntu.edu.sg
Patrick E. HopkinsUniversity of VirginiaVerified email at virginia.edu
Sean A. FischerU.S. Naval Research LaboratoryVerified email at nrl.navy.mil
Oleg N. KaluginV.N. Karazin Kharkiv National UniversityVerified email at karazin.ua
Andrew E. SifainThe University of Texas MD Anderson Cancer CenterVerified email at mdanderson.org

Oleg Prezhdo

Professor of Chemistry, and Physics and Astronomy, University of Southern California

Verified email at usc.edu - Homepage

quantum dynamics nanoscale systems solar energy


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Trajectory Surface Hopping in the Time-Dependent Kohn-Sham Approach<? format?> for Electron-Nuclear Dynamics CF Craig, WR Duncan, OV Prezhdo Physical review letters 95 (16), 163001, 2005	762	2005
The PYXAID program for non-adiabatic molecular dynamics in condensed matter systems AV Akimov, OV Prezhdo Journal of chemical theory and computation 9 (11), 4959-4972, 2013	674	2013
Theoretical Studies of Photoinduced Electron Transfer in Dye-Sensitized TiO₂ WR Duncan, OV Prezhdo Annu. Rev. Phys. Chem. 58 (1), 143-184, 2007	668	2007
Decoherence-induced surface hopping HM Jaeger, S Fischer, OV Prezhdo The Journal of chemical physics 137 (22), 2012	590	2012
Theoretical insights into photoinduced charge transfer and catalysis at oxide interfaces AV Akimov, AJ Neukirch, OV Prezhdo Chemical reviews 113 (6), 4496-4565, 2013	526	2013
Advanced capabilities of the PYXAID program: integration schemes, decoherence effects, multiexcitonic states, and field-matter interaction AV Akimov, OV Prezhdo Journal of chemical theory and computation 10 (2), 789-804, 2014	511	2014
Quantum decoherence and the isotope effect in condensed phase nonadiabatic molecular dynamics simulations BJ Schwartz, ER Bittner, OV Prezhdo, PJ Rossky The Journal of chemical physics 104 (15), 5942-5955, 1996	405	1996
Mean-field molecular dynamics with surface hopping OV Prezhdo, PJ Rossky The Journal of chemical physics 107 (3), 825-834, 1997	395	1997
Unravelling the Effects of Grain Boundary and Chemical Doping on Electron–Hole Recombination in CH₃NH₃PbI₃ Perovskite by Time-Domain Atomistic Simulation R Long, J Liu, OV Prezhdo Journal of the American Chemical Society 138 (11), 3884-3890, 2016	378	2016
Recent progress in surface hopping: 2011–2015 L Wang, A Akimov, OV Prezhdo The journal of physical chemistry letters 7 (11), 2100-2112, 2016	377	2016
Evaluation of quantum transition rates from quantum-classical molecular dynamics simulations OV Prezhdo, PJ Rossky The Journal of chemical physics 107 (15), 5863-5878, 1997	373	1997
Detection of nucleic acids with graphene nanopores: ab initio characterization of a novel sequencing device T Nelson, B Zhang, OV Prezhdo Nano letters 10 (9), 3237-3242, 2010	319	2010
Ab Initio Nonadiabatic Molecular Dynamics of the Ultrafast Electron Injection across the Alizarin−TiO₂ Interface WR Duncan, WM Stier, OV Prezhdo Journal of the American Chemical Society 127 (21), 7941-7951, 2005	309	2005
Ultrafast Carrier Thermalization and Cooling Dynamics in Few-Layer MoS₂ Z Nie, R Long, L Sun, CC Huang, J Zhang, Q Xiong, DW Hewak, Z Shen, ... ACS nano 8 (10), 10931-10940, 2014	307	2014
Breaking the phonon bottleneck in PbSe and CdSe quantum dots: time-domain density functional theory of charge carrier relaxation SV Kilina, DS Kilin, OV Prezhdo Acs Nano 3 (1), 93-99, 2009	304	2009
The two-pathway model for the catch-slip transition in biological adhesion YV Pereverzev, OV Prezhdo, M Forero, EV Sokurenko, WE Thomas Biophysical journal 89 (3), 1446-1454, 2005	275	2005
Quantum zeno effect rationalizes the phonon bottleneck in semiconductor quantum dots SV Kilina, AJ Neukirch, BF Habenicht, DS Kilin, OV Prezhdo Physical review letters 110 (18), 180404, 2013	263	2013
Shape-controlled synthesis of silver nanoparticles: Ab initio study of preferential surface coordination with citric acid DS Kilin, OV Prezhdo, Y Xia Chemical Physics Letters 458 (1-3), 113-116, 2008	260	2008
Instantaneous Generation of Charge-Separated State on TiO₂ Surface Sensitized with Plasmonic Nanoparticles R Long, OV Prezhdo Journal of the American Chemical Society 136 (11), 4343-4354, 2014	256	2014
Quantum Coherence Facilitates Efficient Charge Separation at a MoS₂/MoSe₂ van der Waals Junction R Long, OV Prezhdo Nano letters 16 (3), 1996-2003, 2016	254	2016

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