| Beyond Born-Oppenheimer theory for ab initio constructed diabatic potential energy surfaces of singlet to study reaction dynamics using coupled 3D time … S Ghosh, S Mukherjee, B Mukherjee, S Mandal, R Sharma, P Chaudhury, ... The Journal of Chemical Physics 147 (7), 074105, 2017 | 57 | 2017 |
| The TDDVR approach for molecular photoexcitation, molecule–surface and triatomic reactive scattering processes S Mandal, S Ghosh, S Sardar, S Adhikari International Reviews in Physical Chemistry 37 (3-4), 607-700, 2018 | 26 | 2018 |
| 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), 104103, 2021 | 15 | 2021 |
| Multidimensional stochastic dissipative quantum dynamics using a Lindblad operator S Mandal, F Gatti, O Bindech, R Marquardt, JC Tremblay The Journal of Chemical Physics 156 (9), 094109, 2022 | 10 | 2022 |
| The effect of phonon modes and electron–hole pair couplings on molecule–surface scattering processes S Mandal, T Sahoo, S Ghosh, S Adhikari Journal of Theoretical and Computational Chemistry 14 (04), 1550028, 2015 | 10 | 2015 |
| The effect of surface temperature on H2/D2(v = 0, j = 0)–Ni(100) scattering processes S Mandal, T Sahoo, S Ghosh, S Adhikari Molecular Physics 113 (19-20), 3042-3056, 2015 | 9 | 2015 |
| Stochastic multi-configuration time-dependent Hartree for dissipative quantum dynamics with strong intramolecular coupling S Mandal, F Gatti, O Bindech, R Marquardt, JC Tremblay The Journal of Chemical Physics 157 (14), 144105, 2022 | 7 | 2022 |
| Spin–vibronic mechanism at work in a luminescent square-planar cyclometalated tridentate Pt (ii) complex: absorption and ultrafast photophysics S Mandal, C Daniel Physical Chemistry Chemical Physics 25 (28), 18720-18727, 2023 | 5 | 2023 |
| Ultrafast Excited-State Nonadiabatic Dynamics in Pt (II) Donor–Bridge–Acceptor Assemblies: A Quantum Approach for Optical Control S Mandal, C Daniel The Journal of Physical Chemistry A, 2024 | 1 | 2024 |
| 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 | 1 | 2022 |
| The mean square displacement of a ballistic quantum particle O Bindech, F Gatti, S Mandal, R Marquardt, L Shi, JC Tremblay Molecular Physics, e2322023, 2024 | | 2024 |
| The effect of surface temperature for the scattering of D2 (v = 0, j = 0)- Cu(111) system : A spherical polar TDDVR approach S Mandal, T Sahoo, S Ghosh, S Adhikari Journal of Indian Chemical Socity 92, 291-303, 2015 | | 2015 |
| Nearly Linear Scalability of Time Dependent Discrete Variable Representation (TDDVR) Method for the Dynamics of Multi-Surface Multi-Mode Hamiltonian S Mandal, T Sahoo, S Adhikari | | |
| SPECIAL ISSUE IN HONOUR OF SOURAV PAL S Mandal, T Sahoo, S Ghosh, S Adhikari | | |
