Conical intersections and nonadiabatic coupling terms in 1, 3, 5-C6H3F3+: A six state beyond Born-Oppenheimer treatment S Mukherjee, J Dutta, B Mukherjee, S Sardar, S Adhikari The Journal of Chemical Physics 150 (6), 2019 | 20 | 2019 |
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 | 17 | 2020 |
Effect of surface temperature on quantum dynamics of H2 on Cu (111) using a chemically accurate potential energy surface J Dutta, S Mandal, S Adhikari, P Spiering, J Meyer, MF Somers The Journal of Chemical Physics 154 (10), 2021 | 14 | 2021 |
Topological Effects in Vibronically Coupled Degenerate Electronic States: A Case Study on Nitrate and Benzene Radical Cation S Mukherjee, B Mukherjee, J Dutta, S Sardar, S Adhikari ACS omega 3 (10), 12465-12475, 2018 | 9 | 2018 |
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 | 7 | 2022 |
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 | 4 | 2022 |
Cubic perturbed centrifugally stabilized excited state in orthorhombic manganites J Dutta, S Adhikari, NN Kovaleva The Journal of Chemical Physics 150 (6), 2019 | 4 | 2019 |
Effect of surface temperature on quantum dynamics of D2 on Cu (111) using a chemically accurate potential energy surface J Dutta, K Naskar, S Adhikari, J Meyer, MF Somers The Journal of Chemical Physics 157 (19), 2022 | 3 | 2022 |
Formulation of temperature dependent effective Hartree potential incorporating quadratic over linear molecular DOFs-surface modes couplings and its effect on quantum dynamics … J Dutta, S Mandal, S Adhikari Chemical Physics 552, 111371, 2022 | 3 | 2022 |