Publikationen von J. Mannouch
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Zeitschriftenartikel (6)
2025
Zeitschriftenartikel
Nonadiabatic Dynamics with the Mapping Approach to Surface Hopping (MASH)
, , J. Mannouch
Annual Review of Physical Chemistry (2025)
2024
Zeitschriftenartikel
Toward a Correct Description of Initial Electronic Coherence in Nonadiabatic Dynamics Simulations
The Journal of Physical Chemistry Letters 15 (46), 11687–11695 (2024)
Zeitschriftenartikel
A size-consistent multi-state mapping approach to surface hopping
, J. Mannouch,
The Journal of Chemical Physics 160 (24), 244112 (2024)
Zeitschriftenartikel
Quantum Quality with Classical Cost: Ab Initio Nonadiabatic Dynamics Simulations Using the Mapping Approach to Surface Hopping
The Journal of Physical Chemistry Letters 15 (22), 5814–5823 (2024)
Zeitschriftenartikel
A MASH simulation of the photoexcited dynamics of cyclobutanone
, , J. Mannouch, , , A. Kelly,
The Journal of Chemical Physics 160 (17), 174306 (2024)
Zeitschriftenartikel
Recovering Marcus Theory Rates and Beyond without the Need for Decoherence Corrections: The Mapping Approach to Surface Hopping
, J. Mannouch,
The Journal of Physical Chemistry Letters 15 (3), 707–716 (2024)