| Reconnoitring the nature of interaction and effect of electric field on Pd/Pt/Ni decorated 5-8-5/55–77 defected graphene sheet for hydrogen storage R Akilan, S Vinnarasi, S Mohanapriya, R Shankar International Journal of Hydrogen Energy 45 (1), 744-763, 2020 | 26 | 2020 |
| Reinforcing the tetracene-based two-dimensional C48H16 sheet by decorating the Li, Na, and K atoms for hydrogen storage and environmental application–A DFT study M Subramani, A Rajamani, V Subramaniam, MR Hatshan, S Gopi, ... Environmental Research 204, 112114, 2022 | 17 | 2022 |
| Exploring two-dimensional graphene and boron-nitride as potential nanocarriers for cytarabine and clofarabine anti-cancer drugs V Saravanan, A Rajamani, M Subramani, S Ramasamy Computational Biology and Chemistry 88, 107334, 2020 | 17 | 2020 |
| Revealing the interfacial phenomenon of metal-hydride formation and spillover effect on C48H16 sheet by platinum metal catalyst (Pt (n= 1-4)) for hydrogen storage enhancement M Subramani, D Arumugam, S Ramasamy International Journal of Hydrogen Energy 48 (10), 4016-4034, 2023 | 12 | 2023 |
| Adsorption of H2 molecules on B/N-doped defected graphene sheets—a DFT study R Akilan, S Vinnarasi, S Mohanapriya, R Shankar Structural Chemistry 31, 2413-2434, 2020 | 10 | 2020 |
| Probing the influence of defects and Si-doping in graphene sheet as an efficacious carrier for drug delivery system in gas and aqua phases-Combined DFT and classical MD simulation D Arumugam, M Subramani, R Durai, A Sambasivam, S Ramasamy Journal of Physics and Chemistry of Solids 181, 111562, 2023 | 9 | 2023 |
| Kinetics and degradation of camphene with OH radicals and its subsequent fate under the atmospheric O2 and NO radicals-A theoretical study M Subramani, V Saravanan, J Theerthagiri, V Subramaniam, ... Chemosphere 267, 129250, 2021 | 9 | 2021 |
| Atomic insights into the fluorinated pristine and defected graphene sheets for inducing the electronic and magnetic properties with the aid of scandium metal decoration-Acumen … D Subramani, M Subramani, A Muralidharan, S Ramasamy Journal of Magnetism and Magnetic Materials 587, 171263, 2023 | 8 | 2023 |
| Inquest for the interaction of canonical and non-canonical DNA/RNA bases with ternary based 2D Si2BN and doped Si2BN for biosensing applications A Muralidharan, M Subramani, D Subramani, S Ramasamy Journal of Biomolecular Structure and Dynamics 42 (22), 12446-12477, 2024 | 6 | 2024 |
| Unraveling the potential of transition metals as single atom catalyst in Graphene/WS2 van der Waals heterostructure for enhanced HER performance–A first principles study D Arumugam, M Subramani, D Subramani, S Ramasamy International Journal of Hydrogen Energy 68, 545-558, 2024 | 5 | 2024 |
| Unveiling the structure-property relationships of bimetallic nickel molybdenum metal organic framework for pseudocapacitor electrode materials: A combined approach of … S Kanthasamy, M Subramani, S Ramasamy, S Thangavelu Chemical Engineering Journal 495, 153691, 2024 | 4 | 2024 |
| Probing of sequential atmospheric degradation of chlorine radical initiated 1, 8-cineole in the presence of O2 and NO radical with the emission of secondary pollution V Tamilvanan, M Subramani, D Subramani, S Ramasamy Environmental Pollution 300, 118974, 2022 | 4 | 2022 |
| Kinetics and degradation mechanism of atmospheric isoprene (2‐methyl‐1, 3‐butadiene (C5H8)) with chlorine radical and its derivatives—A theoretical study M Subramani, A Rajamani, R Shankar International Journal of Quantum Chemistry 121 (7), e26573, 2021 | 4 | 2021 |
| Theoretical insights on the development of a 55–77 graphene sheet by embedding Agn= 1-4 and Pdn= 1-4 metal nanoclusters for efficient CO2 capture M Subramani, V Saravanan, A Muralidharan, R Durai, S Ramasamy Journal of Molecular Graphics and Modelling 124, 108573, 2023 | 3 | 2023 |
| Mitigation of indoor pollutants using 2D materials for enrichment of indoor environmental quality and human health: a review M Subramani, A Muralidharan, D Arumugam, A Rajamani, S Ramasamy Current Opinion in Environmental Science & Health 33, 100460, 2023 | 3 | 2023 |
| Benzothiazole-based Schiff base for sensing Ca2+ ions: Synthesis, DFT studies, toxicity evaluation in zebrafish embryo and in silico analysis of MMP-9 inhibition G Sathiyaraj, M Akilesh, A Vignesh, KN Kumar, S Gopinath, ... Journal of Photochemistry and Photobiology A: Chemistry 458, 115985, 2025 | | 2025 |
Akilan RajamaniPostdoctoral Fellow, ICGM UMR CNRS 5253, France在 umontpellier.fr 的电子邮件经过验证
