119 citations · 449 across the 17 of their papers we have counts for
4 papers · 1 filter
Exciton dynamics from the mapping approach to surface hopping: Comparison with Förster and Redfield theories
Johan E. Runeson, Thomas P. Fay, David E. Manolopoulos
We compare the recently introduced multi-state mapping approach to surface hopping (MASH) with the Förster and Redfield theories of excitation energy transfer. Whereas Förster theo…
Which Algorithm Best Propagates the Meyer-Miller-Stock-Thoss Mapping Hamiltonian for Non-Adiabatic Dynamics?
Lauren E. Cook, Johan E. Runeson, Jeremy O. Richardson +1
A common strategy to simulate mixed quantum-classical dynamics is by propagating classical trajectories with mapping variables, often using the Meyer-Miller-Stock-Thoss (MMST) Hami…
How Quantum is the Resonance Behavior in Vibrational Polariton Chemistry?
Marit R. Fiechter, Johan E. Runeson, Joseph E. Lawrence +1
Recent experiments in polariton chemistry have demonstrated that reaction rates can be modified by vibrational strong coupling to an optical cavity mode. Importantly, this modifica…
A multi-state mapping approach to surface hopping
Johan E. Runeson, David E. Manolopoulos
We describe a multiple electronic state adaptation of the mapping approach to surface hopping introduced recently by Mannouch and Richardson (J. Chem. Phys. 158, 104111 (2023)). Th…