Accurate Coupled Cluster Calculations of the Reaction...

Journal of Physical Chemistry A 2009 / 10 Vol. 113; Iss. 43

Accurate Coupled Cluster Calculations of the Reaction Barrier Heights of Two CH 3• + CH 4 Reactions †

Klopper, Wim, Bachorz, Rafał A., Tew, David P., Aguilera-Iparraguirre, Jorge, Carissan, Yannick, Hättig, Christof
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Volume:
113
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp902753s
Date:
October, 2009
File:
PDF, 832 KB
english, 2009
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