| Quantum and quasiclassical studies of the O (3P)+ HCl→ OH+ Cl (2P) reaction using benchmark potential surfaces T Xie, J Bowman, JW Duff, M Braunstein, B Ramachandran The Journal of chemical physics 122 (1), 2005 | 80 | 2005 |
| Potential energy surfaces for the A ″3 and A′ 3 electronic states of the O (3 P)+ HCl system B Ramachandran, KA Peterson The Journal of chemical physics 119 (18), 9590-9600, 2003 | 72 | 2003 |
| Structure and Properties of Fen, Fen–, and Fen+ Clusters, n = 7–20 GL Gutsev, CA Weatherford, P Jena, E Johnson, BR Ramachandran The Journal of Physical Chemistry A 116 (41), 10218-10228, 2012 | 69 | 2012 |
| Mechanical failure of metal/ceramic interfacial regions under shear loading X Zhang, B Zhang, Y Mu, S Shao, CD Wick, BR Ramachandran, WJ Meng Acta Materialia 138, 224-236, 2017 | 64 | 2017 |
| Comparison of Storage Mechanisms in RuO2, SnO2, and SnS2 for Lithium-Ion Battery Anode Materials AS Hassan, K Moyer, BR Ramachandran, CD Wick The Journal of Physical Chemistry C 120 (4), 2036-2046, 2016 | 62 | 2016 |
| Quantum calculations of the rate constant for the O (3 P)+ HCl reaction on new ab initio A ″3 and A′ 3 surfaces T Xie, JM Bowman, KA Peterson, B Ramachandran The Journal of chemical physics 119 (18), 9601-9608, 2003 | 60 | 2003 |
| Dynamics of the O (3 P)+ HCl reaction on the 3 A ″electronic state: A new ab initio potential energy surface, quasi-classical trajectory study, and comparison to experiment B Ramachandran, EA Schrader III, J Senekowitsch, RE Wyatt The Journal of chemical physics 111 (9), 3862-3873, 1999 | 56 | 1999 |
| Computational strategies for evaluating barrier heights for gas-phase reactions of lithium enolates LM Pratt, N Van Nguyên, B Ramachandran The Journal of Organic Chemistry 70 (11), 4279-4283, 2005 | 50 | 2005 |
| Quantum reaction dynamics of on a new ab initio potential energy surface K Nobusada, H Nakamura, Y Lin, B Ramachandran The Journal of Chemical Physics 113 (3), 1018-1026, 2000 | 43 | 2000 |
| An all-electron density functional theory study of the structure and properties of the neutral and singly charged M12 and M13 clusters: M= Sc–Zn GL Gutsev, CW Weatherford, KG Belay, BR Ramachandran, P Jena The journal of chemical physics 138 (16), 2013 | 41 | 2013 |
| Structures and aggregation states of fluoromethyllithium and chloromethyllithium carbenoids in the gas phase and in ethereal solvent LM Pratt, B Ramachandran, JD Xidos, CJ Cramer, DG Truhlar The Journal of Organic Chemistry 67 (22), 7607-7612, 2002 | 41 | 2002 |
| Unravelling the Material Composition Effects on the Gamma Ray Stability of Lead Halide Perovskite Solar Cells: MAPbI3 Breaks the Records AG Boldyreva, LA Frolova, IS Zhidkov, LG Gutsev, EZ Kurmaev, ... The Journal of Physical Chemistry Letters 11 (7), 2630-2636, 2020 | 38 | 2020 |
| Computational strategies for reactions of aggregated and solvated organolithium carbenoids B Ramachandran, P Kharidehal, LM Pratt, S Voit, FN Okeke, M Ewan The Journal of Physical Chemistry A 114 (32), 8423-8433, 2010 | 31 | 2010 |
| 1, 6-Hexanedithiol monolayer as a receptor for specific recognition of alkylmercury HF Ji, Y Zhang, VV Purushotham, S Kondu, B Ramachandran, T Thundat, ... Analyst 130 (12), 1577-1579, 2005 | 31 | 2005 |
| A comparative study of small 3d-metal oxide (FeO) n,(CoO) n, and (NiO) n clusters GL Gutsev, KG Belay, KV Bozhenko, LG Gutsev, BR Ramachandran Physical Chemistry Chemical Physics 18 (40), 27858-27867, 2016 | 30 | 2016 |
| Molecular mechanisms for the lithiation of ruthenium oxide nanoplates as lithium-ion battery anode materials: an experimentally motivated computational study AS Hassan, A Navulla, L Meda, BR Ramachandran, CD Wick The Journal of Physical Chemistry C 119 (18), 9705-9713, 2015 | 29 | 2015 |
| Energy disposal in the reaction: Classical dynamics and comparison to experiment B Ramachandran The Journal of Chemical Physics 112 (8), 3680-3688, 2000 | 29 | 2000 |
| The influence of classical resonances on quantum energy levels B Ramachandran, KG Kay The Journal of chemical physics 99 (5), 3659-3668, 1993 | 29 | 1993 |
| Competition between surface chemisorption and cage formation in Fe12O12 clusters GL Gutsev, CA Weatherford, P Jena, E Johnson, BR Ramachandran Chemical Physics Letters 556, 211-216, 2013 | 27 | 2013 |
| Thermal and state-selected rate coefficients for the O (3P)+ HCl reaction and new calculations of the barrier height and width S Skokov, S Zou, JM Bowman, TC Allison, DG Truhlar, Y Lin, ... The Journal of Physical Chemistry A 105 (11), 2298-2307, 2001 | 27 | 2001 |
Joel BowmanProfessor of Chemistry, Emory UniversityVerified email at emory.edu
