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Reactant zero-point energy is needed to access the saddle point in molecular dynamics calculations of the association reaction H+C2D2→C2D2H∗

✍ Scribed by Han, Yong-Chang; Bowman, Joel M.

Book ID: 123145046
Publisher: Elsevier Science
Year: 2013
Tongue: English
Weight: 587 KB
Volume: 556
Category: Article
ISSN: 0009-2614
DOI: 10.1016/j.cplett.2012.11.055

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