43 citations · 76 across the 3 of their papers we have counts for
5 papers
A general non-adiabatic quantum instanton approximation
Joseph E. Lawrence, David E. Manolopoulos
We present a general quantum instanton approach to calculating reaction rates for systems with two electronic states and arbitrary values of the electronic coupling. This new appro…
An analysis of isomorphic RPMD in the golden rule limit
Joseph E. Lawrence, David E. Manolopoulos
We analyse the golden rule limit of the recently proposed isomorphic ring polymer (iso-RP) method. This method aims to combine an exact expression for the quantum mechanical partit…
On the calculation of quantum mechanical electron transfer rates
Joseph E. Lawrence, Theo Fletcher, Lachlan P. Lindoy +1
We present a simple interpolation formula for the rate of an electron transfer reaction as a function of the electronic coupling strength. The formula only requires the calculation…
Analytic continuation of Wolynes theory into the Marcus inverted regime
Joseph E. Lawrence, David E. Manolopoulos
The Wolynes theory of electronically nonadiabatic reaction rates [P. G. Wolynes, J. Chem. Phys. 87, 6559 (1987)] is based on a saddle point approximation to the time integral of a…
Magnetoelectroluminescence in organic light emitting diodes
Joseph E. Lawrence, Alan M. Lewis, David E. Manolopoulos +1
The magnetoelectroluminescence of conjugated organic polymer films is widely accepted to arise from a polaron pair mechanism, but their magnetoconductance is less well understood.…