| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5374804 | Chemical Physics | 2011 | 9 Pages |
Abstract
⺠Acetone-chloroform mixtures containing an ionic or a neutral solute are investigated through molecular dynamics simulations. ⺠The primary goal is to look at the nonideal aspects of dynamical properties with variation of composition. ⺠The diffusion coefficients of different particles are found to show nonideal behavior of different characteristics. ⺠Calculations of solute-solvent distribution functions reveal the extent and nature of selective solvation. ⺠The hydrogen bond lifetimes of acetone-chloroform pairs in these mixtures are also calculated.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Rini Gupta, Amalendu Chandra,