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Photodissociation of Methane

Authors: Susan Karplus; Richard Bersohn;

Photodissociation of Methane

Abstract

A valence-bond calculation is carried out on the ground and six excited energy levels of methane. The molecule is deformed in a C2v fashion so as to produce incipiently CH2 and H2, and in a C3v fashion to obtain CH3 and H. Potential surfaces are obtained which permit one with classical mechanics to determine the shape of the molecule during its dissociation. The crude calculation leads to three principal results: (1) the lowest excited state is a forbidden E state; (2) in the next-highest allowed T2 state there is a steeper potential gradient in the CH3 and H direction than in the CH2 and H2 direction; the reverse is true for the E state; and (3) the CH2 derived from the allowed T2 state is produced in an electronically excited state. It follows that, unless there is a crossover from T2 to E, the red bands of CH2 should be observable in emission when methane is photolyzed.

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citations
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
30
Average
Top 10%
Top 10%
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