| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5394414 | Computational and Theoretical Chemistry | 2013 | 7 Pages |
Abstract
⺠A large nitrogen-only cage with D3h symmetry is studied with high-level computations. ⺠Cylindrical shape is an important factor for the stability of nitrogen-only cage molecules. ⺠Pentagons on the side of the cylinder and triangles on the caps play important roles for the stability of the sylinder. ⺠Calculations show that the N66 cage is a novel nanomaterial (beeline nanotube).
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Hongwei Zhou, Michaël Beuve, Fan Yang, Ning-Bew Wong, Wai-Kee Li,