Supramolecular interactions between fullerenes and porphyrins

被引：199

作者：

Wang, YB ^{[1
]}

Lin, ZY ^{[1
]}

机构：

[1] Hong Kong Univ Sci & Technol, Dept Chem, Kowloon, Hong Kong, Peoples R China

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 2003年 / 125卷 / 20期

关键词：

D O I：

10.1021/ja028998g

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

Perdew-Burke-Ernzerhof density functional theory calculations have been carried out to investigate the host-guest interactions for several fullerene-porphyrin supramolecular complexes. The nature of the interactions has been discussed. The fullerene-porphyrin interaction energies for the complexes studied are found to be in the range from -16 to -18 kcal/mol. Copyright © 2003 American Chemical Society.

引用

页码：6072 / 6073

页数：2

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