Revisiting the reaction energetics of the CH 3 O+ O 2 (3 Σ−) reaction: the crucial role of post-CCSD (T) corrections S Mallick, A Kumar, P Kumar Physical Chemistry Chemical Physics 21 (12), 6559-6565, 2019 | 23 | 2019 |
Effect of ammonia and formic acid on the CH 3 O+ O 2 reaction: a quantum chemical investigation A Kumar, S Mallick, BK Mishra, P Kumar Physical Chemistry Chemical Physics 22 (4), 2405-2413, 2020 | 20 | 2020 |
Influence of water on the CH 3 O+ O 2→ CH 2 O+ HO 2 reaction S Mallick, A Kumar, BK Mishra, P Kumar Physical Chemistry Chemical Physics 21 (28), 15734-15741, 2019 | 20 | 2019 |
Effect of water on the oxidation of CO by a Criegee intermediate A Kumar, S Mallick, P Kumar Physical Chemistry Chemical Physics 22 (37), 21257-21266, 2020 | 13 | 2020 |
Kinetic instability of sulfurous acid in the presence of ammonia and formic acid S Mallick, A Kumar, P Kumar Physical Chemistry Chemical Physics 22 (33), 18646-18654, 2020 | 13 | 2020 |
Oxidation of HOSO by NH2: A new path for the formation of an acid rain precursor S Mallick, A Kumar, P Kumar Chemical Physics Letters 773, 138536, 2021 | 11 | 2021 |
CO 2 as an auto-catalyst for the oxidation of CO by a Criegee intermediate (CH 2 OO) A Kumar, P Kumar Physical Chemistry Chemical Physics 22 (13), 6975-6983, 2020 | 11 | 2020 |
Oxidation of HOSO˙ by Cl˙: a new source of SO 2 in the atmosphere? A Kumar, S Mallick, P Kumar Physical Chemistry Chemical Physics 23 (34), 18707-18711, 2021 | 8 | 2021 |
OH+ HCl Reaction on the Surface of Ice: An Ab Initio Molecular Dynamics Study A Kumar, P Kumar The Journal of Physical Chemistry A 126 (9), 1504-1510, 2022 | 7 | 2022 |
Gas phase acidity of water clusters A Kumar, P Kumar Physical Chemistry Chemical Physics 24 (30), 18236-18244, 2022 | 6 | 2022 |
Formation of unexpected S–S covalent bonds in H 2 S dimers under confinement A Kumar, P Kumar Physical Chemistry Chemical Physics 23 (10), 5963-5968, 2021 | 6 | 2021 |
The effect of ammonia and formic acid on the oxidation of CO via a simple Criegee intermediate A Kumar, P Kumar Physical Chemistry Chemical Physics 23 (9), 5392-5406, 2021 | 6 | 2021 |
Can Ozone Dissociate at the Surface of Water (Water Droplet and Ice) without Light? A Kumar, P Kumar The Journal of Physical Chemistry A 127 (47), 10016-10025, 2023 | 3 | 2023 |
Nitrous acid (HONO) as a sink of the simplest Criegee intermediate in the atmosphere A Kumar, S Mallick, P Kumar Physical Chemistry Chemical Physics 24 (12), 7458-7465, 2022 | 3 | 2022 |
Can water molecules bind by the oxygen oxygen covalent bond? A confinement induced bonding A Kumar, P Kumar Computational and Theoretical Chemistry 1206, 113493, 2021 | 3 | 2021 |
Dissociation of H 2 O 2 on water surfaces (ice and water droplets) A Kumar, P Kumar Physical Chemistry Chemical Physics 26 (15), 11331-11339, 2024 | 1 | 2024 |
Can N2O act as a catalyst in the Atmosphere? A case study for the oxidation of CO by Criegee intermediate (CH2OO) VJ Anand, A Kumar, P Kumar Computational and Theoretical Chemistry 1215, 113829, 2022 | 1 | 2022 |
How the two-center three-electron hemibond affect the inversion barrier of NH in X-NH complex (X = F, Cl and Br) A Kumar, P Kumar Journal of Chemical Sciences 136 (3), 48, 2024 | | 2024 |
Nitrous Acid (HONO) Dissociation on the Water and Ice Surface: An Ab Initio Molecular Dynamics Study A Kumar, VJ Anand, P Kumar The Journal of Physical Chemistry A, 2024 | | 2024 |
Effect of (H 2 O) n (n= 1 and 2) on HOCl+ Cl reaction A Kumar, P Kumar Physical Chemistry Chemical Physics 25 (12), 8948-8960, 2023 | | 2023 |