Quantum localization and delocalization of charge carriers in organic semiconducting crystals S Giannini, A Carof, M Ellis, H Yang, OG Ziogos, S Ghosh, J Blumberger Nature communications 10 (1), 1-12, 2019 | 191 | 2019 |
Co(salophen)-Catalyzed Aerobic Oxidation of p-Hydroquinone: Mechanism and Implications for Aerobic Oxidation Catalysis CW Anson, S Ghosh, S Hammes-Schiffer, SS Stahl Journal of the American Chemical Society 138 (12), 4186-4193, 2016 | 137 | 2016 |
How a CoIV ^..... O 2+ Fragment Oxidizes Water: Involvement of a Biradicaloid CoII–(⋅ O⋅) 2+ Species in Forming the O O Bond DW Crandell, S Ghosh, CP Berlinguette, MH Baik ChemSusChem 8 (5), 844-852, 2015 | 62 | 2015 |
Electrochemical solvent reorganization energies in the framework of the polarizable continuum model S Ghosh, S Horvath, AV Soudackov, S Hammes-Schiffer Journal of chemical theory and computation 10 (5), 2091-2102, 2014 | 50 | 2014 |
The Mechanism of O O Bond Formation in Tanaka’s Water Oxidation Catalyst S Ghosh, MH Baik Angewandte Chemie International Edition 51 (5), 1221-1224, 2012 | 50 | 2012 |
Spectroscopic and computational study of a nonheme iron nitrosyl center in a biosynthetic model of nitric oxide reductase S Chakraborty, J Reed, M Ross, MJ Nilges, ID Petrik, S Ghosh, ... Angewandte Chemie International Edition 53 (9), 2417-2421, 2014 | 48 | 2014 |
Electrochemical electron transfer and proton-coupled electron transfer: effects of double layer and ionic environment on solvent reorganization energies S Ghosh, AV Soudackov, S Hammes-Schiffer Journal of chemical theory and computation 12 (6), 2917-2925, 2016 | 41 | 2016 |
Redox properties of Tanaka’s water oxidation catalyst: Redox noninnocent ligands dominate the electronic structure and reactivity S Ghosh, MH Baik Inorganic chemistry 50 (13), 5946-5957, 2011 | 41 | 2011 |
Flexible Ligand in a Molecular Cu Electrocatalyst Unfurls Bidirectional O2/H2O Conversion in Water A Ali, D Prakash, P Majumder, S Ghosh, A Dutta ACS Catalysis 11, 5934-5941, 2021 | 34 | 2021 |
Nonadiabatic dynamics with quantum nuclei: Simulating charge transfer with ring polymer surface hopping S Ghosh, S Giannini, K Lively, J Blumberger Faraday Discussions, 2019 | 33 | 2019 |
Theoretical insights into proton-coupled electron transfer from a photoreduced ZnO nanocrystal to an organic radical S Ghosh, J Castillo-Lora, AV Soudackov, JM Mayer, S Hammes-Schiffer Nano letters 17 (9), 5762-5767, 2017 | 33 | 2017 |
Photo‐Rechargeable Li‐Ion Batteries using TiS2 Cathode A Kumar, R Hammad, M Pahuja, R Arenal, K Ghosh, S Ghosh, ... Small 19 (38), 2303319, 2023 | 28 | 2023 |
Calculation of Electrochemical Reorganization Energies for Redox Molecules at Self-Assembled Monolayer Modified Electrodes S Ghosh, S Hammes-Schiffer The journal of physical chemistry letters 6 (1), 1-5, 2014 | 28 | 2014 |
Addition of Si–H and B–H Bonds and Redox Reactivity Involving Low-Coordinate Nitrido–Vanadium Complexes R Thompson, BL Tran, S Ghosh, CH Chen, M Pink, X Gao, PJ Carroll, ... Inorganic chemistry 54 (6), 3068-3077, 2015 | 25 | 2015 |
A four-coordinate thionitrosyl complex of vanadium BL Tran, R Thompson, S Ghosh, X Gao, CH Chen, MH Baik, DJ Mindiola Chemical Communications 49 (27), 2768-2770, 2013 | 20 | 2013 |
A N-Heterocyclic Carbene Supported Zinc Catalyst for the 1,2-Regioselective Hydroboration of N-heteroarenes DM Sumana Mondal, Tejender Singh, Sudip Baguli, Soumya Ghosh Chemistry A European Journal, 2023 | 13 | 2023 |
Mechanism of Redox‐Active Ligand‐Assisted Nitrene‐Group Transfer in a ZrIV Complex: Direct Ligand‐to‐Ligand Charge Transfer Preferred S Ghosh, MH Baik Chemistry–A European Journal 21 (4), 1780-1789, 2015 | 11 | 2015 |
3site Multisubstrate-Bound State of Cytochrome P450cam M Sahil, T Singh, S Ghosh, J Mondal Journal of the American Chemical Society 145 (43), 23488-23502, 2023 | 9 | 2023 |
Role of Proton Diffusion in the nonexponential kinetics of proton-coupled electron transfer from photoreduced ZnO nanocrystals S Ghosh, AV Soudackov, S Hammes-Schiffer ACS nano 11 (10), 10295-10302, 2017 | 8 | 2017 |
Understanding electrochemical interfaces through comparing experimental and computational charge density–potential curves N Mohandas, S Bawari, JJT Shibuya, S Ghosh, J Mondal, TN Narayanan, ... Chemical Science 15 (18), 6643-6660, 2024 | 6 | 2024 |