Article ID Journal Published Year Pages File Type
5389161 Chemical Physics Letters 2007 4 Pages PDF
Abstract
The effects of surface trapped electrons on the dynamics of HCl adsorbed ice surfaces have been demonstrated by Car-Parrinello molecular dynamics simulations. The existence of excess electrons can lead to extensive structural and electronic changes of ice surfaces, which provide better environments for interlayer proton transfer and subsequent heterogeneous reactions.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
, ,