Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5391975 | Chemical Physics Letters | 2006 | 6 Pages |
Abstract
The dehydrogenation reaction for the LiHâ¦HF system was examined using the density functional theory calculations. This study demonstrates that the microsolvation effect can drive the initial LiHâ¦HF complex transforming into the Li+â¦HHâ¦Fâ system with the formation of an HH covalent bond.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Hsin-Yi Liao,