Efficient EOM-CC-based protocol for the calculation of electron affinity of solvated nucleobases: Uracil as a case study M Mukherjee, D Tripathi, M Brehm, C Riplinger, AK Dutta Journal of Chemical Theory and Computation 17 (1), 105-116, 2020 | 17 | 2020 |
Water mediated electron attachment to nucleobases: Surface-bound vs bulk solvated electrons M Mukherjee, D Tripathi, AK Dutta The Journal of Chemical Physics 153 (4), 2020 | 17 | 2020 |
Novel thiazoline-phenothiazine based “push-pull” molecules as fluorescent probes for volatile acids detection S Chaudhary, M Mukherjee, TK Paul, S Taraphder, MD Milton Journal of Photochemistry and Photobiology A: Chemistry 397, 112509, 2020 | 13 | 2020 |
Interactions of solvated electrons with nucleobases: The effect of base pairing S Ranga, M Mukherjee, AK Dutta ChemPhysChem 21 (10), 1019-1027, 2020 | 13 | 2020 |
Novel Phenothiazine‐5‐oxide Based Push‐Pull Molecules: Synthesis and Fine‐Tuning of Electronic, Optical and Thermal Properties S Chaudhary, M Mukherjee, TK Paul, S Bishnoi, S Taraphder, MD Milton ChemistrySelect 3 (18), 5073-5081, 2018 | 12 | 2018 |
Spectroscopic signatures of states in the continuum characterized by a joint experimental and theoretical study of pyrrole M Mukherjee, TP Ragesh Kumar, M Ranković, P Nag, J Fedor, AI Krylov The Journal of Chemical Physics 157 (20), 2022 | 8 | 2022 |
Solvation effect on the vertical ionization energy of adenine‐thymine base pair: From microhydration to bulk M Mukherjee, S Haldar, AK Dutta International Journal of Quantum Chemistry 120 (6), e26127, 2020 | 5 | 2020 |
Exploring the Global Reaction Coordinate for Retinal Photoisomerization: A Graph Theory-Based Machine Learning Approach G Giudetti, M Mukherjee, S Nandi, S Agrawal, O Prezhdo, A Nakano | | 2023 |
Shape resonance induced electron attachment to Cytosine: The effect of aqueous media P Verma, M Mukherjee, D Bhattacharya, I Haritan, AK Dutta Journal of Chemical Physics 159, 214303, 2023 | | 2023 |
New insights into electronic resonances of pyrrole derived from complex absorbing potential calculations M Mukherjee, AI Krylov | | |