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Comparisons of CBS-q and G2 calculations on thermodynamic properties, transition states, and kinetics of dimethyl-ether + O2 reaction system

✍ Scribed by T. Yamada; J. W. Bozzelli; T. H. Lay


Publisher
John Wiley and Sons
Year
2000
Tongue
English
Weight
429 KB
Volume
32
Category
Article
ISSN
0538-8066

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✦ Synopsis


Reaction pathways and kinetics are analyzed on the CH 3 OC• H 2 ϩ O 2 reaction system using thermodynamic properties (⌬H S and C p (T )'s 300 Յ T/K Յ 1500) derived Њ , Њ , f