Published December 3, 2013
| Published
Journal Article
Open
Reprint of: RRKM reaction rate theory for transition states of any looseness
- Creators
- Wardlaw, David M.
-
Marcus, R. A.
Abstract
Unimolecular rate theory for various types of reactions is implemented for any looseness of transition state. Quantum states are counted for all but the "transitional" modes, their phase space being counted via Monte Carlo sampling. The rate constant k_(EJ) is then weighted with the initial E and J distributions.
Additional Information
© 2013 Elsevier B.V. Available online 21 August 2013. This research was supported by a grant from the National Science Foundation.Attached Files
Published - 1-s2.0-S0009261413010713-main.pdf
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Additional details
- Eprint ID
- 43175
- Resolver ID
- CaltechAUTHORS:20140102-111251066
- NSF
- Created
-
2014-01-09Created from EPrint's datestamp field
- Updated
-
2021-11-10Created from EPrint's last_modified field