الفهرس | Only 14 pages are availabe for public view |
Abstract In this thesis we have studied theoretically the structure and stability of Mg+2XH3OH complexes (X= C, Si and Ge) in gas phase and their possible fragmentation channels to gives the evidence for detecting complexes of Mg+2 dication with a single XH3OH molecule using density functional theory (DFT) and multilevel ab initio calculations. |