Electronically Unsaturated Three‐Coordinate Aluminum Hydride and Organoaluminum Cations B Prashanth, M Bhandari, S Ravi, KR Shamasundar, S Singh Chemistry–A European Journal 24 (19), 4794-4799, 2018 | 54 | 2018 |
ADT: A Generalized Algorithm and Program for Beyond Born–Oppenheimer Equations of “N” Dimensional Sub-Hilbert Space K Naskar, S Mukherjee, B Mukherjee, S Ravi, S Mukherjee, S Sardar, ... Journal of Chemical Theory and Computation 16 (3), 1666-1680, 2020 | 34 | 2020 |
Reactivity of a dihydroboron species: synthesis of a hydroborenium complex and an expedient entry into stable thioxo-and selenoxo-boranes K Jaiswal, B Prashanth, S Ravi, KR Shamasundar, S Singh Dalton Transactions 44 (36), 15779-15785, 2015 | 22 | 2015 |
The role of electron–nuclear coupling on multi-state photoelectron spectra, scattering processes and phase transitions J Dutta, S Mukherjee, K Naskar, S Ghosh, B Mukherjee, S Ravi, ... Physical Chemistry Chemical Physics 22 (47), 27496-27524, 2020 | 21 | 2020 |
Two Different Pathways in the Reduction of [(S=)PCl(μ‐NtBu)]2 with Na D Bawari, B Prashanth, S Ravi, KR Shamasundar, S Singh, DS Wright Chemistry–A European Journal 22 (34), 12027-12033, 2016 | 18 | 2016 |
Beyond Born–Oppenheimer constructed diabatic potential energy surfaces for F+ H2 reaction B Mukherjee, K Naskar, S Mukherjee, S Ravi, KR Shamasundar, ... The Journal of Chemical Physics 153 (17), 2020 | 16 | 2020 |
A beyond Born–Oppenheimer treatment of C6H6+ radical cation for diabatic surfaces: Photoelectron spectra of its neutral analog using time-dependent discrete variable representation S Mukherjee, S Ravi, K Naskar, S Sardar, S Adhikari The Journal of Chemical Physics 154 (9), 2021 | 15 | 2021 |
Non-adiabatic coupling as a frictional force in (He, H, H)+ dynamics and the formation of HeH2+ S Ravi, S Mukherjee, B Mukherjee, S Adhikari, N Sathyamurthy, M Baer Molecular Physics 119 (4), e1811907, 2021 | 11 | 2021 |
Construction of Beyond Born‐Oppenheimer Based Diabatic Surfaces and Generation of Photoabsorption Spectra: The Touchstone Pyrazine (C4N2H4) S Hazra, S Mukherjee, S Ravi, S Sardar, S Adhikari ChemPhysChem 23 (23), e202200482, 2022 | 10 | 2022 |
Beyond Born–Oppenheimer based diabatic surfaces of 1, 3, 5-C 6 H 3 F 3+ to generate the photoelectron spectra using time-dependent discrete variable representation approach S Mukherjee, S Ravi, J Dutta, S Sardar, S Adhikari Physical Chemistry Chemical Physics 24 (4), 2185-2202, 2022 | 9 | 2022 |
Non-adiabatic coupling and conical intersection(s) between potential energy surfaces for HeH2 + AK Gupta, V Dhindhwal, M Baer, N Sathyamurthy, S Ravi, S Mukherjee, ... Molecular Physics 118 (12), e1683243, 2020 | 8 | 2020 |
Beyond Born–Oppenheimer Constructed Diabatic Potential Energy Surfaces for HeH2+ K Naskar, S Ravi, S Adhikari, M Baer, N Sathyamurthy The Journal of Physical Chemistry A 127 (17), 3832-3847, 2023 | 7 | 2023 |
Jahn–Teller Effect in Orthorhombic Manganites: Ab Initio Hamiltonian and Roto-vibrational Spectrum J Dutta, S Ravi, S Mukherjee, AK Ojha, S Adhikari The Journal of Physical Chemistry A 126 (5), 691-709, 2022 | 7 | 2022 |
Non-adiabatic coupling as a frictional force in the formation of H3+: a model dynamical study S Ravi, S Mukherjee, B Mukherjee, S Adhikari, N Sathyamurthy, M Baer The European Physical Journal D 74, 1-13, 2020 | 6 | 2020 |
Ab-initio study on the covalent nature of hydrogen bonding in cellobiose S Mittal, S Prasad, RS Payal, S Ravi Cellulose 30 (2), 689-704, 2023 | 3 | 2023 |
Photochemistry of 3,6-Didehydropyridazine Biradical─An Untraceable Para Benzyne Analogue M Saraswat, S Ravi, KR Shamasundar, S Venkataramani The Journal of Physical Chemistry A 126 (4), 557-567, 2022 | 3 | 2022 |
Aluminum containing molecular bowls and pyridinophanes: use of pyridine modules to access different molecular topologies D Bawari, C Negi, VK Porwal, S Ravi, KR Shamasundar, S Singh Dalton Transactions 48 (21), 7442-7450, 2019 | 3 | 2019 |
The quantum mechanical non-adiabatic coupling term as friction in the formation of DH2+ M Baer, S Mukherjee, S Ravi, S Adhikari, N Sathyamurthy Advances in Quantum Chemistry 89, 291-304, 2024 | 2 | 2024 |
Experimental evaluation for analgesic activity of Mamsyadi Kwatha. S Shreevathsa, B Ravishankar, RR Dwivedi, SR Ravi, MS Krishnamurthy | 2 | 2011 |
Ab initio Modeling of Hydrogen Bonding of Remdesivir and Adenosine with Uridine K Vishwakarma, S Ravi, S Mittal ChemPhysChem 25 (3), e202300552, 2024 | 1 | 2024 |