| 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 | 341 | 2016 |
| 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 | 264 | 2014 |
| 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 | 238 | 2014 |
| Photo-induced Charge Separation across the Graphene–TiO2 Interface Is Faster than Energy Losses: A Time-Domain ab Initio Analysis R Long, NJ English, OV Prezhdo Journal of the American Chemical Society 134 (34), 14238-14248, 2012 | 235 | 2012 |
| 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 | 218 | 2016 |
| Reduced-dimensional perovskite photovoltaics with homogeneous energy landscape T He, S Li, Y Jiang, C Qin, M Cui, L Qiao, H Xu, J Yang, R Long, H Wang, ... Nature communications 11 (1), 1672, 2020 | 177 | 2020 |
| Synergistic effects on band gap-narrowing in titania by codoping from first-principles calculations R Long, NJ English Chemistry of Materials 22 (5), 1616-1623, 2010 | 158 | 2010 |
| A‐site Cation Engineering for Highly Efficient MAPbI3 Single‐Crystal X‐ray Detector Y Huang, L Qiao, Y Jiang, T He, R Long, F Yang, L Wang, X Lei, M Yuan, ... Angewandte Chemie International Edition 58 (49), 17834-17842, 2019 | 151 | 2019 |
| High-performance large-area quasi-2D perovskite light-emitting diodes C Sun, Y Jiang, M Cui, L Qiao, J Wei, Y Huang, L Zhang, T He, S Li, ... Nature communications 12 (1), 2207, 2021 | 143 | 2021 |
| Efficient and stable inverted perovskite solar cells incorporating secondary amines H Chen, Q Wei, MI Saidaminov, F Wang, A Johnston, Y Hou, Z Peng, K Xu, ... Advanced Materials 31 (46), 1903559, 2019 | 140 | 2019 |
| Moderate humidity delays electron–hole recombination in hybrid organic–inorganic perovskites: time-domain ab initio simulations rationalize experiments R Long, W Fang, OV Prezhdo The Journal of Physical Chemistry Letters 7 (16), 3215-3222, 2016 | 138 | 2016 |
| Ab Initio Nonadiabatic Molecular Dynamics of the Ultrafast Electron Injection from a PbSe Quantum Dot into the TiO2 Surface R Long, OV Prezhdo Journal of the American Chemical Society 133 (47), 19240-19249, 2011 | 137 | 2011 |
| Time-domain ab initio modeling of photoinduced dynamics at nanoscale interfaces L Wang, R Long, OV Prezhdo Annual review of physical chemistry 66, 549-579, 2015 | 136 | 2015 |
| Sulfur Adatom and Vacancy Accelerate Charge Recombination in MoS2 but by Different Mechanisms: Time-Domain Ab Initio Analysis L Li, R Long, T Bertolini, OV Prezhdo Nano letters 17 (12), 7962-7967, 2017 | 132 | 2017 |
| Control of Charge Carriers Trapping and Relaxation in Hematite by Oxygen Vacancy Charge: Ab Initio Non-adiabatic Molecular Dynamics Z Zhou, J Liu, R Long, L Li, L Guo, OV Prezhdo Journal of the American Chemical Society 139 (19), 6707-6717, 2017 | 132 | 2017 |
| First-principles calculation of nitrogen-tungsten codoping effects on the band structure of anatase-titania R Long, NJ English Applied physics letters 94 (13), 2009 | 130 | 2009 |
| Doping‐Induced Amorphization, Vacancy, and Gradient Energy Band in SnS2 Nanosheet Arrays for Improved Photoelectrochemical Water Splitting L Meng, S Wang, F Cao, W Tian, R Long, L Li Angewandte Chemie 131 (20), 6833-6837, 2019 | 128 | 2019 |
| Donor–Acceptor Interaction Determines the Mechanism of Photoinduced Electron Injection from Graphene Quantum Dots into TiO2: π-Stacking Supersedes … R Long, D Casanova, WH Fang, OV Prezhdo Journal of the American Chemical Society 139 (7), 2619-2629, 2017 | 124 | 2017 |
| Charge Separation and Recombination in Two-Dimensional MoS2/WS2: Time-Domain ab Initio Modeling L Li, R Long, OV Prezhdo Chemistry of Materials 29 (6), 2466-2473, 2017 | 122 | 2017 |
| Band gap engineering of (N, Ta)-codoped TiO2: A first-principles calculation R Long, NJ English Chemical Physics Letters 478 (4-6), 175-179, 2009 | 117 | 2009 |
