How to recover Marcus theory with fewest switches surface hopping: Add just a touch of decoherence

Surface hopping with Ehrenfest excited potential

(2011) Sean A. Fischer et al.   JOURNAL OF CHEMICAL PHYSICS

A new approach to decoherence and momentum rescaling in the surface hopping algorithm

(2011) Joseph E. Subotnik et al.   JOURNAL OF CHEMICAL PHYSICS

Decoherence and surface hopping: When can averaging over initial conditions help capture the effects of wave packet separation?

(2011) Joseph E. Subotnik et al.   JOURNAL OF CHEMICAL PHYSICS

Simultaneous-trajectory surface hopping: A parameter-free algorithm for implementing decoherence in nonadiabatic dynamics

(2011) Neil Shenvi et al.   JOURNAL OF CHEMICAL PHYSICS

Communication: Standard surface hopping predicts incorrect scaling for Marcus’ golden-rule rate: The decoherence problem cannot be ignored

(2011) Brian R. Landry et al.   JOURNAL OF CHEMICAL PHYSICS

Fewest-Switches Surface Hopping and Decoherence in Multiple Dimensions

(2011) Joseph E. Subotnik   JOURNAL OF PHYSICAL CHEMISTRY A

Nonadiabatic Dynamics of Uracil: Population Split among Different Decay Mechanisms

(2011) Dana Nachtigallová et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Role of Solvent Dynamics in Ultrafast Photoinduced Proton-Coupled Electron Transfer Reactions in Solution

(2010) Anirban Hazra et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Electronically Nonadiabatic Dynamics via Semiclassical Initial Value Methods

(2009) William H. Miller   JOURNAL OF PHYSICAL CHEMISTRY A

Nonadiabatic Molecular Dynamics Simulations of the Energy Transfer between Building Blocks in a Phenylene Ethynylene Dendrimer†

(2009) Sebastian Fernandez-Alberti et al.   JOURNAL OF PHYSICAL CHEMISTRY A