- 作者: 廖欣怡
- 作者服務機構: Department of Science Education, National Taipei University of Education, Taipei 10659, Taiwan, R.O.C.
- 中文摘要: The F–H···YZ2 (Y = C, Si, BH, AlH; Z = H, PH3) systems were examined using density functional theory calculations. The main focus of this work is to demonstrate that the chemistry of Y(PH3)2 exhibits a novel feature which is a central Y atom with unexpect
- 英文摘要: --
- 中文關鍵字: Unconventional hydrogen bonds; Density functional theory; HOMO-LUMO gap; Donor-acceptor interaction.
- 英文關鍵字: --