| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5355877 | Applied Surface Science | 2012 | 8 Pages |
Abstract
⺠We explored the adsorption behavior of the SCNâ on outer surface BNNTs via DFT. ⺠We reported the NBO charge distribution of SCNâ on BNNTs surface. ⺠Chemisorptions are observed for SCNâ on Al- and Ga-doped BNNTs. ⺠Notable changes are observed in the electronic properties of BNNT after doping.
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Alireza Soltani, Nasim Ahmadian, Yaser Kanani, Aliakbar Dehnokhalaji, Hossein Mighani,