| Confinement induced binding of noble gas atoms M Khatua, S Pan, PK Chattaraj The Journal of Chemical Physics 140 (16), 2014 | 68 | 2014 |
| Movement of Ng2 molecules confined in a C60 cage: an ab initio molecular dynamics study M Khatua, S Pan, PK Chattaraj Chemical Physics Letters 610, 351-356, 2014 | 45 | 2014 |
| A tug-of-war between electronic excitation and confinement in a dynamical context U Sarkar, M Khatua, PK Chattaraj Phys. Chem. Chem. Phys. 14, 1716, 2011 | 42 | 2011 |
| Reactivity dynamics of a confined molecule in presence of an external magnetic field M Khatua, U Sarkar, PK Chattaraj International Journal of Quantum Chemistry 115 (3), 144-157, 2015 | 30 | 2015 |
| Reactivity dynamics of confined atoms in the presence of an external magnetic field M Khatua, U Sarkar, PK Chattaraj The European Physical Journal D 68, 1-9, 2014 | 29 | 2014 |
| Confinement of (HF) 2 in Cn (n= 60, 70, 80, 90) cages M Khatua, S Pan, PK Chattaraj Chemical Physics Letters 616, 49-54, 2014 | 15 | 2014 |
| A Design Criteria to Achieve Giant Ising‐Type Anisotropy in CoII‐Encapsulated Metallofullerenes MK Singh, P Shukla, M Khatua, G Rajaraman Chemistry–A European Journal 26 (2), 464-477, 2020 | 14 | 2020 |
| Molecular Reactivity Dynamics in a Confined Environment M Khatua, P Chattaraj Phys. Chem. Chem. Phys. 15, 5588, 2013 | 14 | 2013 |
| Bohmian trajectory from the “classical” Schrödinger equation S Sengupta, M Khatua, PK Chattaraj Chaos: An Interdisciplinary Journal of Nonlinear Science 24 (4), 2014 | 9 | 2014 |
| In silico design to enhance the barrier height for magnetization reversal in Dy (iii) sandwich complexes by stitching them under the umbrella of corannulene T Sharma, MK Singh, R Gupta, M Khatua, G Rajaraman Chemical Science 12 (34), 11506-11514, 2021 | 8 | 2021 |
| Density dynamics in some quantum systems M Khatua, D Chakraborty, PK Chattaraj International Journal of Quantum Chemistry 113 (13), 1747, 2013 | 8 | 2013 |
| 14 Quantum Fluid Density Functional Theory and Chemical Reactivity Dynamics S Giri, S Duley, M Khatua, U Sarkar, PK Chattaraj Quantum Trajectories, 223, 2016 | 2 | 2016 |
| Fluxionality Modulating the Magnetic Anisotropy in Lanthanoarene [(ηCnRn)2Ln(II/III)] (n = 4–8) Single-Ion Magnets A Swain, RK Tiwari, M Khatua, G Rajaraman Inorganic Chemistry 62 (24), 9552-9562, 2023 | 1 | 2023 |
| Reactivity and Dynamics in Confined Atoms and Molecules M Khatua IIT Kharagpur, 2015 | | 2015 |
Pratim Kumar ChattarajDistinguished Visiting Professor, Department of Chemistry, Birla Institute of Technology MesraE-mail confirmado em bitmesra.ac.in
