| Surface hopping excited-state dynamics study of the photoisomerization of a light-driven fluorene molecular rotary motor A Kazaryan, Z Lan, LV Schafer, W Thiel, M Filatov Journal of chemical theory and computation 7 (7), 2189-2199, 2011 | 165 | 2011 |
| A first principles study of fluorescence quenching in rhodamine B dimers: how can quenching occur in dimeric species? D Setiawan, A Kazaryan, MA Martoprawiro, M Filatov Physical Chemistry Chemical Physics 12 (37), 11238-11244, 2010 | 134 | 2010 |
| Understanding the dynamics behind the photoisomerization of a light-driven fluorene molecular rotary motor A Kazaryan, JCM Kistemaker, LV Schäfer, WR Browne, BL Feringa, ... The Journal of Physical Chemistry A 114 (15), 5058-5067, 2010 | 129 | 2010 |
| Excitation Energies from Spin-Restricted Ensemble-Referenced Kohn− Sham Method: A State-Average Approach A Kazaryan, J Heuver, M Filatov The Journal of Physical Chemistry A 112 (50), 12980-12988, 2008 | 62 | 2008 |
| Ligand field effects and the high spin–high reactivity correlation in the H abstraction by non-heme iron (IV)–oxo complexes: A DFT frontier orbital perspective A Kazaryan, EJ Baerends ACS Catalysis 5 (3), 1475-1488, 2015 | 57 | 2015 |
| Catalytic oxidation of water with high-spin iron (IV)–oxo species: Role of the water solvent L Bernasconi, A Kazaryan, P Belanzoni, EJ Baerends ACS Catalysis 7 (6), 4018-4025, 2017 | 43 | 2017 |
| Density Functional Study of the Ground and Excited State Potential Energy Surfaces of a Light-Driven Rotary Molecular Motor (3R,3′R)-(P,P)-trans-1,1′,2,2 … A Kazaryan, M Filatov The Journal of Physical Chemistry A 113 (43), 11630-11634, 2009 | 43 | 2009 |
| Assessment of density functional methods for reaction energetics: Iridium‐catalyzed water oxidation as case study A Kazaryan, EJ Baerends Journal of Computational Chemistry 34 (10), 870-878, 2013 | 36 | 2013 |
| Light-induced water splitting by titanium-tetrahydroxide: a computational study A Kazaryan, R van Santen, EJ Baerends Physical Chemistry Chemical Physics 17 (31), 20308-20321, 2015 | 17 | 2015 |
| Solvent induced enhancement of enantiomeric excess: a case study of the Henry reaction with cinchona thiourea as the catalyst M Heshmat, A Kazaryan, EJ Baerends Physical Chemistry Chemical Physics 16 (16), 7315-7323, 2014 | 15 | 2014 |
| Theoretical modeling of the dynamics of photo-excited states in light-driven molecular rotary motors AK Kazaryan | 3 | 2011 |
Michael Filatov在 thch.uni-bonn.de 的电子邮件经过验证
