Electronic Resource
College Park, Md.
:
American Institute of Physics (AIP)
The Journal of Chemical Physics
98 (1993), S. 3968-3971
ISSN:
1089-7690
Source:
AIP Digital Archive
Topics:
Physics
,
Chemistry and Pharmacology
Notes:
The rate of electron transfer was studied in typical organic molecules. The approach is based on a Green's function technique which allows one to account for multiscattering electron tunneling. Quantum-chemical calculations are used to obtain the parameters of dynamical Dyson's equations for relevant double-time retarded Green's function. The parameters are used to estimate electron tunneling rate including neutral and mononegative ions of the α, ω-diphenylalkanes with different numbers of methyl groups. The role of bridge as the conductor of an extra electron is demonstrated from results of the calculations.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1063/1.464024
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