Electronic Resource
College Park, Md.
:
American Institute of Physics (AIP)
The Journal of Chemical Physics
99 (1993), S. 5849-5857
ISSN:
1089-7690
Source:
AIP Digital Archive
Topics:
Physics
,
Chemistry and Pharmacology
Notes:
We discuss an effective numerical method for obtaining the best trajectory to be used in the classical path approach. The method is based upon a time dependent variational method, which yields from first principles the classical path equations. In its simplest formulation the classical path equations contain an optimal momentum determined self-consistently. A variational method, which satisfies detailed balance is also discussed.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1063/1.465938
Permalink
Library |
Location |
Call Number |
Volume/Issue/Year |
Availability |