| Role of post-CCSD (T) corrections in predicting the energetics and kinetics of the OH˙+ O 3 reaction PK Rai, P Kumar Physical Chemistry Chemical Physics 24 (21), 13026-13032, 2022 | 6 | 2022 |
| External electric field to control the Diels–Alder reactions of endohedral fullerene P Yadav, PK Rai, S Mallick, P Kumar Physical Chemistry Chemical Physics 24 (18), 11131-11136, 2022 | 5 | 2022 |
| How an electric field makes endohedral fullerene an improved catalyst for hydrogen evolution reaction P Yadav, PK Rai, P Kumar Computational and Theoretical Chemistry 1221, 114026, 2023 | 3 | 2023 |
| Oxidation of HOSO˙ by O 2 (3 Σ g−): a key reaction deciding the fate of HOSO˙ in the atmosphere PK Rai, S Sarkar, B Bandyopadhyay, P Kumar Physical Chemistry Chemical Physics 24 (26), 16274-16280, 2022 | 2 | 2022 |
| Accurate estimation of singlet-triplet gap of strongly correlated systems by CCSD (T) method using improved orbitals S Mallick, PK Rai, P Kumar Computational and Theoretical Chemistry 1202, 113326, 2021 | 2 | 2021 |
| Accurate determination of reaction energetics and kinetics of the HO 2˙+ O 3→ OH˙+ 2O 2 reaction PK Rai, P Kumar Physical Chemistry Chemical Physics 25 (11), 8153-8160, 2023 | 1 | 2023 |
| HO 2• _2^∙+ O3→ OH•+ 2O2 reaction: A potential source of vibrationally hot OH radicals in the atmosphere PK Rai, P Kumar International Journal of Chemical Kinetics 55 (10), 619-628, 2023 | | 2023 |
Pradeep KumarMNIT JaipurVerified email at mnit.ac.in
