Kinetic isotope effects for the H2 + C2H
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Liping Ju; Dongsheng Wang
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Article
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2010
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John Wiley and Sons
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English
β 184 KB
## Abstract In the present paper, kinetic isotope effects of the title reaction are studied with canonical variational transition state theory on the modified Wang Bowman (MWB) potential energy surface (PES) (__Chem Phys Lett__ 2005, 409, 249) and the ab initio calculations at the quadratic configu