| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5392738 | Computational and Theoretical Chemistry | 2016 | 10 Pages |
Abstract
For titanium modifying β-cyclodextrin, hydrogen molecules are absorbed inside cavity of it, the frontier orbitals of β-cyclodextrin are evidently delocalized, and the adsorption energy between β-cyclodextrin and hydrogen are enlarged.117
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Caihua Zhou, Yijun Guo, Haiyan Zhu, Guang Fan,