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Modified collision theory activation parameters for F + H2 (D2): comparison of ab initio calculations and experiment

✍ Scribed by Hiroshi Furue; Philip D. Pacey

Publisher: Elsevier Science
Year: 1986
Tongue: English
Weight: 258 KB
Volume: 129
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(86)80168-3

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✦ Synopsis

Activation parameters, a temperature-independent factor, an effective barrier height and a characteristic tunneling temperature, have been deduced from ab titio quantum chemical calculations and have been estimated from experiment. For the most recent calculations, agreement is satisfactory.

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