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Tapas Sahoo
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Beyond Born–Oppenheimer theory for spectroscopic and scattering processes
B Mukherjee, K Naskar, S Mukherjee, S Ghosh, T Sahoo, S Adhikari
International Reviews in Physical Chemistry 38 (3-4), 287-341, 2019
412019
Low-temperature D++ H2 reaction: A time-dependent coupled wave-packet study in hyperspherical coordinates
T Sahoo, S Ghosh, S Adhikari, R Sharma, AJC Varandas
The Journal of Chemical Physics 142 (2), 2015
312015
Coupled 3D Time-Dependent Wave-Packet Approach in Hyperspherical Coordinates: Application to the Adiabatic Singlet-State(11A′) D+ + H2 Reaction
T Sahoo, S Ghosh, S Adhikari, R Sharma, AJC Varandas
The Journal of Physical Chemistry A 118 (26), 4837-4850, 2014
302014
Coupled 3D Time-Dependent Wave-Packet Approach in Hyperspherical Coordinates: The D++H2 Reaction on the Triple-Sheeted DMBE Potential Energy Surface
S Ghosh, T Sahoo, S Adhikari, R Sharma, AJC Varandas
The Journal of Physical Chemistry A 119 (50), 12392-12403, 2015
272015
Selective bond breaking mediated by state specific vibrational excitation in model HOD molecule through optimized femtosecond IR pulse: A simulated annealing based approach
BK Shandilya, S Sen, T Sahoo, S Talukder, P Chaudhury, S Adhikari
The Journal of Chemical Physics 139 (3), 2013
182013
Effect of Surface Modes on the Six-Dimensional Molecule–Surface Scattering Dynamics of H2–Cu(100) and D2–Cu(111) Systems
T Sahoo, S Sardar, P Mondal, B Sarkar, S Adhikari
The Journal of Physical Chemistry A 115 (21), 5256-5273, 2011
182011
The effect of phonon modes on the H 2 (v, j)/D 2 (v, j)–Cu (1nn) scattering processes
T Sahoo, S Sardar, S Adhikari
Physical Chemistry Chemical Physics 13 (21), 10100-10110, 2011
182011
Dressed adiabatic and diabatic potentials to study conical intersections for F+ H2
A Das, T Sahoo, D Mukhopadhyay, S Adhikari, M Baer
The Journal of Chemical Physics 136 (5), 2012
152012
Charge Transfer Processes for H + H2+ Reaction Employing Coupled 3D Wavepacket Approach on Beyond Born–Oppenheimer Based Ab Initio Constructed …
S Ghosh, T Sahoo, M Baer, S Adhikari
The Journal of Physical Chemistry A 125 (3), 731-745, 2021
122021
Surface temperature effect on the scattering of D2 (v= 0, j= 0)-Cu (111) system
T Sahoo, S Mukherjee, S Adhikari
The Journal of Chemical Physics 136 (8), 2012
122012
The effect of phonon modes on the D2 (v= 0, j= 0)–Cu (111) scattering processes
T Sahoo, S Sardar, S Adhikari
Physica Scripta 84 (2), 028105, 2011
122011
A path integral ground state replica trick approach for the computation of entanglement entropy of dipolar linear rotors
T Sahoo, D Iouchtchenko, CM Herdman, PN Roy
The Journal of Chemical Physics 152 (18), 2020
102020
A path integral ground state approach for asymmetric top rotors with nuclear spin symmetry: Application to water chains
T Sahoo, T Serwatka, PN Roy
The Journal of Chemical Physics 154 (24), 2021
92021
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
82015
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
82015
Nearly Linear Scalability of Time-Dependent Discrete Variable Representation (TDDVR) Method for the Dynamics of Multi-Surface Multi-Mode Hamiltonian
BA Khan, S Sardar, T Sahoo, P Sarkar, S Adhikari
Journal of Theoretical and Computational Chemistry 12 (05), 1350042, 2013
82013
Second order classical perturbation theory for the sticking probability of heavy atoms scattered on surfaces
T Sahoo, E Pollak
The Journal of chemical physics 143 (6), 2015
42015
Effect of neighbouring molecules on ground-state properties of many-body polar linear rotor systems
T Sahoo, G Gangopadhyay
https://arxiv.org/abs/2305.17637, 2023
12023
Comparison of physical processes of atom-surface scattering computed by classical and quantum dynamics
T Sahoo
https://arxiv.org/abs/2306.17483v3, 2023
2023
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
J. Indian Chem. Soc. 92, 291-303, 2015
2015
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