Wardlaw, David M. and Marcus, R. A. (1984) RRKM reaction rate theory for transition states of any looseness. Chemical Physics Letters, 110 (3). pp. 230-234. ISSN 0009-2614. doi:10.1016/0009-2614(84)85219-7. https://resolver.caltech.edu/CaltechAUTHORS:20150629-102705959
Full text is not posted in this repository. Consult Related URLs below.
Use this Persistent URL to link to this item: https://resolver.caltech.edu/CaltechAUTHORS:20150629-102705959
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.
| Item Type: | Article | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Related URLs: |
| |||||||||
| ORCID: |
| |||||||||
| Additional Information: | © 1984 Elsevier Science Publishers B.V. Received 6 July 1984, in final form 19 July 1984. This research was supported by a grant from the National Science Foundation. | |||||||||
| Funders: |
| |||||||||
| Other Numbering System: |
| |||||||||
| Issue or Number: | 3 | |||||||||
| DOI: | 10.1016/0009-2614(84)85219-7 | |||||||||
| Record Number: | CaltechAUTHORS:20150629-102705959 | |||||||||
| Persistent URL: | https://resolver.caltech.edu/CaltechAUTHORS:20150629-102705959 | |||||||||
| Official Citation: | David M. Wardlaw, R.A. Marcus, RRKM reaction rate theory for transition states of any looseness, Chemical Physics Letters, Volume 110, Issue 3, 28 September 1984, Pages 230-234, ISSN 0009-2614, http://dx.doi.org/10.1016/0009-2614(84)85219-7. (http://www.sciencedirect.com/science/article/pii/0009261484852197) | |||||||||
| Usage Policy: | No commercial reproduction, distribution, display or performance rights in this work are provided. | |||||||||
| ID Code: | 58663 | |||||||||
| Collection: | CaltechAUTHORS | |||||||||
| Deposited By: | Tony Diaz | |||||||||
| Deposited On: | 06 Jul 2015 17:31 | |||||||||
| Last Modified: | 10 Nov 2021 22:08 |
Repository Staff Only: item control page
