An analysis of the O3DMBE potential energy surface is performed using unconventional contour maps. In this way alternative paths leading to the same products (microscopic branching) are singled out. The detailed J = O quantum probabilities and related mode selectivity and energy disposal obtained through an extensive computational campaign on the EGEE production Grid are interpreted in terms of the mentioned alternative reactive paths. Â© 2009 Wiley Periodicals, Inc.
|Titolo:||Microscopic branching processes: The O + O2 reaction and its relaxed potential representations|
|Data di pubblicazione:||2010|
|Parole Chiave:||Energy disposal; Microscopic branching; Mode selectivity; Oxygen exchange reaction; Relaxed potential representations; Atomic and Molecular Physics, and Optics; Condensed Matter Physics; Physical and Theoretical Chemistry|
|Digital Object Identifier (DOI):||http://dx.doi.org/10.1002/qua.22199|
|Appare nelle tipologie:||1.1 Articolo in rivista|