Alexey V Akimov

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Oleg PrezhdoProfessor of Chemistry, and Physics and Astronomy, University of Southern CaliforniaBestätigte E-Mail-Adresse bei usc.edu
Anatoly KolomeiskyProfessor of Chemistry, Professor of Chemical and Biomolecular Engineering, Professor of PhysicsBestätigte E-Mail-Adresse bei rice.edu
Mohamed El-Amine MadjetBremen Center for Computational Materials Science, GermanyBestätigte E-Mail-Adresse bei uni-bremen.de
Golibjon BerdiyorovQatar Environment and Energy Research Institute, Doha, QatarBestätigte E-Mail-Adresse bei hbku.edu.qa
Alexander NemukhinProfessor, Moscow State UniversityBestätigte E-Mail-Adresse bei lcc.chem.msu.ru
Nijamudheen AUniversity of OxfordBestätigte E-Mail-Adresse bei chem.ox.ac.uk
Ryosuke JinnouchiToyota Central R&D Labs., Inc.Bestätigte E-Mail-Adresse bei mosk.tytlabs.co.jp
Amanda NeukirchLos Alamos National LaboratroyBestätigte E-Mail-Adresse bei lanl.gov
Sabre KaisGoodnight Distinguished Chair in Quantum Computing”, ECE at NC StateBestätigte E-Mail-Adresse bei ncsu.edu
Fedwa El-MellouhiSenior Scientist, Qatar Environment and Energy Research InstituteBestätigte E-Mail-Adresse bei hbku.edu.qa
Dhara TrivediAssistant Professor, Clarkson UniversityBestätigte E-Mail-Adresse bei clarkson.edu
Ekadashi PradhanYork UniversityBestätigte E-Mail-Adresse bei ualberta.ca
Wei Li （李位）UMONS, Hunan Agricultural University, Jilin UniversityBestätigte E-Mail-Adresse bei hunau.edu.cn
Nikolai SinitsynLos Alamos National LaboratoryBestätigte E-Mail-Adresse bei lanl.gov
Liujiang ZhouProfessor, University of Electronic Science and Technology of ChinaBestätigte E-Mail-Adresse bei uestc.edu.cn
Thomas FrauenheimProfessor für Computational Materials ScienceBestätigte E-Mail-Adresse bei bccms.uni-bremen.de
Bálint AradiSenior Researcher, BCCMS, University of BremenBestätigte E-Mail-Adresse bei uni-bremen.de
Linjun WangUniversity of Sourthern CaliforniaBestätigte E-Mail-Adresse bei usc.edu
Fahhad H AlharbiKing Fahd University of Petroleum & MineralsBestätigte E-Mail-Adresse bei kfupm.edu.sa
James M. TourProfessor, Rice University, Department of Chemistry, Materials Science and NanoEngineering, andBestätigte E-Mail-Adresse bei rice.edu

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Alexey V Akimov

Associate Professor, University at Buffalo, SUNY

Bestätigte E-Mail-Adresse bei buffalo.edu - Startseite

quantum and molecular dynamics electronic structure theory nanotechnology and material science


Titel Nach Zitationen sortieren Nach Jahr sortieren Nach Titel sortieren	Zitiert von Zitiert von	Jahr
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	696	2013
Theoretical insights into photoinduced charge transfer and catalysis at oxide interfaces AV Akimov, AJ Neukirch, OV Prezhdo Chemical reviews 113 (6), 4496-4565, 2013	534	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	530	2014
Recent progress in surface hopping: 2011–2015 L Wang, A Akimov, OV Prezhdo The journal of physical chemistry letters 7 (11), 2100-2112, 2016	393	2016
Large-Scale Computations in Chemistry: A Bird's Eye View of a Vibrant Field A Akimov, O Prezhdo Chem. Rev., 2015	243	2015
Persistent electronic coherence despite rapid loss of electron–nuclear correlation AV Akimov, OV Prezhdo The Journal of Physical Chemistry Letters 4 (22), 3857-3864, 2013	204	2013
Evidence of Production in Collisions at and Limits on Anomalous Quartic Gauge Couplings with the ATLAS Detector G Aad, B Abbott, J Abdallah, S Abdel Khalek, O Abdinov, R Aben, B Abi, ... Physical review letters 115 (3), 031802, 2015	182	2015
Nonadiabatic Dynamics of Charge Transfer and Singlet Fission at the Pentacene/C₆₀ Interface AV Akimov, OV Prezhdo Journal of the American Chemical Society 136 (4), 1599-1608, 2014	167	2014
Spin–orbit interactions greatly accelerate nonradiative dynamics in lead halide perovskites W Li, L Zhou, OV Prezhdo, AV Akimov ACS Energy Letters 3 (9), 2159-2166, 2018	133	2018
Nonadiabatic dynamics of positive charge during photocatalytic water splitting on GaN (10-10) surface: charge localization governs splitting efficiency AV Akimov, JT Muckerman, OV Prezhdo Journal of the American Chemical Society 135 (23), 8682-8691, 2013	127	2013
What Makes the Photocatalytic CO₂ Reduction on N-Doped Ta₂O₅ Efficient: Insights from Nonadiabatic Molecular Dynamics AV Akimov, R Asahi, R Jinnouchi, OV Prezhdo Journal of the American Chemical Society 137 (35), 11517-11525, 2015	124	2015
Nonadiabatic molecular dynamics for thousand atom systems: a tight-binding approach toward PYXAID S Pal, DJ Trivedi, AV Akimov, B Aradi, T Frauenheim, OV Prezhdo Journal of chemical theory and computation 12 (4), 1436-1448, 2016	123	2016
Cation effect on hot carrier cooling in halide perovskite materials ME Madjet, GR Berdiyorov, F El-Mellouhi, FH Alharbi, AV Akimov, S Kais The journal of physical chemistry letters 8 (18), 4439-4445, 2017	122	2017
Nonradiative electron–hole recombination rate is greatly reduced by defects in monolayer black phosphorus: ab initio time domain study R Long, W Fang, AV Akimov The journal of physical chemistry letters 7 (4), 653-659, 2016	114	2016
Coherence penalty functional: A simple method for adding decoherence in Ehrenfest dynamics AV Akimov, R Long, OV Prezhdo The Journal of chemical physics 140 (19), 2014	107	2014
Molecular dynamics of surface-moving thermally driven nanocars AV Akimov, AV Nemukhin, AA Moskovsky, AB Kolomeisky, JM Tour Journal of chemical theory and computation 4 (4), 652-656, 2008	95	2008
A simple phase correction makes a big difference in nonadiabatic molecular dynamics AV Akimov The journal of physical chemistry letters 9 (20), 6096-6102, 2018	90	2018
Accurate computation of nonadiabatic coupling with projector augmented-wave pseudopotentials W Chu, Q Zheng, AV Akimov, J Zhao, WA Saidi, OV Prezhdo The Journal of Physical Chemistry Letters 11 (23), 10073-10080, 2020	89	2020
Libra: an open‐source “methodology discovery” library for quantum and classical dynamics simulations AV Akimov Journal of computational chemistry 37 (17), 1626-1649, 2016	89	2016
Modeling nonadiabatic dynamics in condensed matter materials: some recent advances and applications B Smith, AV Akimov Journal of Physics: Condensed Matter 32 (7), 073001, 2019	72	2019

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