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On transition-state theory and the classical mechanics of collinear collisions

✍ Scribed by Pechukas, Philip


Book ID
120983680
Publisher
American Institute of Physics
Year
1973
Tongue
English
Weight
656 KB
Volume
58
Category
Article
ISSN
0021-9606

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On the exactness of classical transition
✍ Erik K. Grimmelmann; Lawrence L. Lohr Jr. πŸ“‚ Article πŸ“… 1977 πŸ› Elsevier Science 🌐 English βš– 409 KB

WC have appl~tl Pcchukas aEd Mclafterty'i tclt for the cxactnoss of classical transItion state theory (TST) to t[lc cnllrncar subsurface of Porter and Karplus' H3 hypcrsurface and have detcrmmcd that TS r is c\act to at lca~t o.0592131 cv above the saddle point energy.