Title of article :
Electrostriction effects on competing transition states in supercritical fluoroform
Author/Authors :
Parsons، نويسنده , , Drew F. and Boone، نويسنده , , Bradley I. and Jessop، نويسنده , , Philip G. and Tucker، نويسنده , , Susan C.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2002
Abstract :
A compressible continuum model for supercritical fluoroform is used to model enantiomeric selectivities measured experimentally by Jessop et al. While oversimplified models, which exaggerate the importance of the electrostriction effect, do produce a non-monotonic density-dependence similar to that observed experimentally, more realistic continuum calculations do not. From these more realistic calculations we conclude that although electrostriction can cause the high-density limit of such selectivities to be attained at much lower densities than would be expected in the absence of electrostriction, it would be very unlikely for this effect to generate a non-monotonic density dependence.
Keywords :
electrostriction , Local density , Compressibility , reaction , Solvation
Journal title :
Journal of Supercritical Fluids
Journal title :
Journal of Supercritical Fluids