## Abstract Herein, we report a high‐level theoretical study (SCS‐RI‐MP2(full)/aug‐cc‐pVTZ) examining the stacking affinity of 1,3,5‐triethynylbenzene. The stacking properties of this compound are compared to those of benzene and 1,3,5‐trifluorobenzene. The results indicate that the ethynyl substit
Electrostatic studies of π–π interaction for benzene stacking on a graphene layer
✍ Scribed by Hsun Su, Yen; Kai Wu, Yang; Tu, Sheng‐Lung; Chang, Shoou-Jinn
- Book ID
- 118163123
- Publisher
- American Institute of Physics
- Year
- 2011
- Tongue
- English
- Weight
- 1002 KB
- Volume
- 99
- Category
- Article
- ISSN
- 0003-6951
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