Unravelling the adsorption performance of BN, AlN, GaN and InN 2D nanosheets towards the ciclopirox, 5-fluorouracil and nitrosourea for anticancer drug delivery motive: A DFT-D … T Ahmed, MA Rahman, R Islam, AA Piya, SUD Shamim Computational and Theoretical Chemistry, 113797, 2022 | 27 | 2022 |
Thickness dependent numerical investigations of lead free perovskite/CIGS bilayer solar cell using SCAPS-1D M Islam, T Ahmed, SUD Shamim, AA Piya, A Basak Chemistry of Inorganic Materials 2, 100034, 2024 | 11 | 2024 |
Exploring the adsorption performance of doped graphene quantum dots as anticancer drug carriers for cisplatin by DFT, PCM, and COSMO approaches KN Munny, T Ahmed, AA Piya, SUD Shamim Structural Chemistry 34 (6), 2089-2105, 2023 | 11 | 2023 |
Trivalent and pentavalent atoms doped boron nitride nanosheets as Favipiravir drug carriers for the treatment of COVID-19 using computational approaches AA Piya, T Ahmed, MA Khaleque, K Ahmed, SUD Shamim Computational and Theoretical Chemistry 1217, 113902, 2022 | 10 | 2022 |
Performance evaluation of lead free CH3NH3SnI3/GeTe Tandem solar cell with HTL layer by SCAPS 1D T Ahmed, SUD Shamim, SK Maity, A Basak Optik 282, 170836, 2023 | 7 | 2023 |
Assessing the sensing performance of Janus transition metal dichalcogenides (ScSSe, TiSSe and ZrSSe) for oxygen-containing toxic gas molecules such as CO, NO, NO2 and SO2 SR Khoshnobish, T Ahmed, T Arefin, AA Piya, SUD Shamim Applied Surface Science 679, 161301, 2025 | 3 | 2025 |
Understanding the adsorption performance of TG, T-BN, T-AlN, and T-GaN nanosheets toward the thioguanine anticancer drug via DFT calculations MN Sakib, T Ahmed, MA Shafiulla, DF Afroj, AA Piya, SUD Shamim AIP Advances 14 (3), 2024 | 3 | 2024 |
Recent advances in Zr and Hf-based MXenes and their hetero-structure as novel anode materials for Ca-ion batteries: theoretical insights from DFT approach T Ahmed, AA Piya, SUD Shamim Nanoscale Advances, 2024 | 3 | 2024 |
Assessment of the drug delivery potential of graphene, boron nitride and their in-plane doped structures for hydroxyurea anti-cancer drug via DFT study MH Opi, T Ahmed, MR Swarna, AA Piya, SUD Shamim Nanoscale Advances 6 (20), 5042-5054, 2024 | 2 | 2024 |
Understanding the adsorption performance of hetero-nanocages (C 12–B 6 N 6, C 12–Al 6 N 6, and B 6 N 6–Al 6 N 6) towards hydroxyurea anticancer drug: a comprehensive study … MR Swarna, MH Opi, T Ahmed, AA Piya, U Habiba, SUD Shamim Nanoscale Advances 6 (23), 5988-6007, 2024 | | 2024 |