On possible simplifications in the theoretical description of gas phase atomic cluster dissociation
نویسندگان
چکیده
منابع مشابه
On possible simplifications in the theoretical description of gas phase atomic cluster dissociation.
In this work, we investigate the possibility of describing gas phase atomic cluster dissociation by means of variational transition state theory (vTST) in the microcanonical ensemble. A particular emphasis is placed on benchmarking the accuracy of vTST in predicting the dissociation rate and kinetic energy release of a fragmentation event as a function of the cluster size and internal energy. T...
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ژورنال
عنوان ژورنال: The Journal of Chemical Physics
سال: 2009
ISSN: 0021-9606,1089-7690
DOI: 10.1063/1.3078449