Application of the ReaxFF Reactive Force Field to Reactive Dynamics of Hydrocarbon Chemisorption and Decomposition

Title
Application of the ReaxFF Reactive Force Field to Reactive Dynamics of Hydrocarbon Chemisorption and Decomposition
Authors
Keywords
-
Journal
Journal of Physical Chemistry C
Volume 114, Issue 12, Pages 5675-5685
Publisher
American Chemical Society (ACS)
Online
2010-01-28
DOI
10.1021/jp9089003

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