DFT investigation of the potential of porous cages for the catalysis of ammonia borane dehydrogenation
| Title | DFT investigation of the potential of porous cages for the catalysis of ammonia borane dehydrogenation |
| Publication Type | Journal Article |
| Year of Publication | 2011 |
| Authors | Pal, A, Vanka, K |
| Journal | Chemical Communications |
| Volume | 47 |
| Issue | 41 |
| Pagination | 11417-11419 |
| Date Published | SEP |
| Type of Article | Article |
| ISSN | 1359-7345 |
| Abstract | Full DFT based quantum mechanical studies reveal that zero dimensional porous structures, especially the newly proposed phosphorus incorporated organic cages, can be excellent catalysts for the dehydrogenation of ammonia borane. |
| DOI | 10.1039/c1cc13285g |
| Type of Journal (Indian or Foreign) | Foreign |
| Impact Factor (IF) | 5.96 |
Divison category:
Physical and Materials Chemistry