DOI: 10.1002/bbpc.19820860519. Analysis of the Resonance in the Three Dimensional F + H<sub>2</sub> Reaction

Analysis of the Resonance in the Three Dimensional F + H2 Reaction

10.1002/bbpc.19820860519

Crossref journal-article

Wiley

Berichte der Bunsengesellschaft für physikalische Chemie (311)

Abstract

AbstractQuantum mechanical resonance structure in the three‐dimensional F + H2 reaction is analyzed in several ways: wavefunction density and flux maps in the transition state region, Argand diagrams which show the energy variation of S‐matrix elements, the time delay computed from the energy derivative of the phase of S‐matrix elements, and the energy variation of nodes in the product channel translational wavefunctions. In addition, differential cross sections for the v = 0 → v' = 2 reaction, computed from quantum reaction probabilities in an optical model, are compared with experimental data. These results are correlated with other recent theoretical results on this reaction, and some remaining theoretical problems are discussed.

Bibliography

Wyatt, R. E., McNutt, J. F., & Redmon, M. J. (1982). Analysis of the Resonance in the Three Dimensional F + H2 Reaction. Berichte Der Bunsengesellschaft FÃ¼r Physikalische Chemie, 86(5), 437â448. Portico.

Authors 3

Robert E. Wyatt (first)
Joe F. McNutt (additional)
Michael J. Redmon (additional)

References 53 Referenced 49

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{'key': 'e_1_2_1_34_2', 'first-page': '372', 'volume-title': 'International School of Physics‐Enrico Fermi', 'author': 'Karplus M.', 'year': '1970'} / International School of Physics‐Enrico Fermi by Karplus M. (1970)
N.Agmon to be published.
V. K.BabamovandA.Kuppermann J. Chem. Phys. to be published.
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{'key': 'e_1_2_1_43_2', 'first-page': '58', 'volume-title': 'III', 'author': 'Schaefer H. F.', 'year': '1979'} / III by Schaefer H. F. (1979)
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Dates

Type	When
Created	13 years, 1 month ago (July 31, 2012, 10:39 a.m.)
Deposited	1 year, 9 months ago (Nov. 13, 2023, 5:16 p.m.)
Indexed	1 year, 6 months ago (Feb. 10, 2024, 1:21 p.m.)
Issued	43 years, 4 months ago (May 1, 1982)
Published	43 years, 4 months ago (May 1, 1982)
Published Online	15 years, 4 months ago (May 6, 2010)
Published Print	43 years, 4 months ago (May 1, 1982)

Funders 0

None

BibTeX

@article{Wyatt_1982, title={Analysis of the Resonance in the Three Dimensional F + H2 Reaction}, volume={86}, ISSN={0005-9021}, url={http://dx.doi.org/10.1002/bbpc.19820860519}, DOI={10.1002/bbpc.19820860519}, number={5}, journal={Berichte der Bunsengesellschaft für physikalische Chemie}, publisher={Wiley}, author={Wyatt, Robert E. and McNutt, Joe F. and Redmon, Michael J.}, year={1982}, month=may, pages={437–448} }

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