| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5382568 | Chemical Physics Letters | 2013 | 6 Pages |
Abstract
⺠Unusual geometries for hydronium ions interacting with water/methanol are explored. ⺠Stronger than expected interactions are present in those regions. ⺠Hydronium-water force fields may require re-parameterization. ⺠New force fields may lead to solvation of hydronium in bulk water. ⺠Larger water capture cross section are expected for H+(H2O)n clusters in gas phase.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Massimo Mella,