| 1 |
Exploration of assisting behavior of molecular-MO2 (M = Ti, Zr) reagents towards the detoxication of tabun: A DFT study
Ash T, Debnath T, Sarkar S, Gurey P, Das AK
Chemical Physics Letters, 717, 164, 2019 |
| 2 |
Dehydrocyclization of diamine borane and amine-borane alcohol catalyzed by 1-lithio-2-alkyl-1,2-dihydropyridine and its Na & K analogues: A DFT analysis of the reaction mechanism
Ghosh A, Debnath T, Ash T, Das AK
International Journal of Hydrogen Energy, 44(54), 28731, 2019 |
| 3 |
Exploration of unprecedented catalytic dehydrogenation mechanism of methylamine-water mixture in presence of Ru-pincer complex: A systematic DFT study
Debnath T, Ash T, Ghosh A, Sarkar S, Das AK
Journal of Catalysis, 363, 164, 2018 |
| 4 |
Dehydrogenation of lithium hydrazinidoborane: Insight from computational analysis
Banu T, Sen K, Ash T, Das AK
International Journal of Hydrogen Energy, 41(42), 18953, 2016 |
| 5 |
Exploration of Binding Interactions of Cu2+ with D-Penicillamine and its O- and Se- Analogues in Both Gas and Aqueous Phases: A Theoretical Approach
Ash T, Debnath T, Banu T, Das AK
Journal of Physical Chemistry B, 120(14), 3467, 2016 |
