Journal of Chemical Physics, Vol.102, No.23, 9285-9295, 1995
Nonadiabatic Effects on the Charge-Transfer Rate-Constant - A Numerical Study of a Simple-Model System
Keywords:ELECTRON-TRANSFER REACTIONS;FLUX CORRELATION-FUNCTIONS;THERMAL RATE CONSTANTS;MECHANICAL RATE CONSTANTS;PATH INTEGRAL TECHNIQUES;TRANSITION-STATE THEORY;RATE COEFFICIENTS;BIMOLECULAR REACTIONS;QUANTUM SIMULATION;CLASSICAL DYNAMICS