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A Chebyshev method for calculating state-to-state reaction probabilities from the time...

Authors :
Althorpe, Stuart C.
Kouri, Donald J.
Source :
Journal of Chemical Physics; 5/8/1997, Vol. 106 Issue 18, p7629, 8p, 3 Charts
Publication Year :
1997

Abstract

Discusses a Chebyshev method for calculating state-to-state reaction probabilities from the time-independent wavepacket reactant-product decoupling equations. Derivation of the extended Chebyshev propagator; Comparison of the extended Chebyshev propagator with related methods.

Details

Language :
English
ISSN :
00219606
Volume :
106
Issue :
18
Database :
Complementary Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
4212283
Full Text :
https://doi.org/10.1063/1.473766