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Consistent treatment of quantum-mechanical and classical degrees of freedom in mixed....

Authors :
Muller, Uwe
Stock, Gerhard
Source :
Journal of Chemical Physics; 5/8/1998, Vol. 108 Issue 18, p7516, 11p, 7 Graphs
Publication Year :
1998

Abstract

Presents a mixed quantum-classical formulation of nonadiabatic molecular processes. Introduction of mapping approach to interpret the intricate concept of vibrational motion; Description of electronic and nuclear degrees of freedom results in the mapping formalism; Virtues and limitations of various mixed quantum-classical descriptions.

Details

Language :
English
ISSN :
00219606
Volume :
108
Issue :
18
Database :
Complementary Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
4177485
Full Text :
https://doi.org/10.1063/1.476184