Haupttitel:
Barrier-crossing transition-path times for non-Markovian systems
Autor*in:
Lavacchi, Laura; Netz, Roland R.
Datum der Freigabe:
2025-01-23T14:31:39Z
Abstract:
By simulation and asymptotic theory, we investigate the transition-path time of a one-dimensional finite-mass reaction coordinate crossing a double-well potential in the presence of non-Markovian friction. First, we consider single-exponential memory kernels and demonstrate that memory accelerates transition paths compared to the Markovian case, especially in the low-mass/high-friction limit. Then, we generalize to multi-exponential kernels and construct an asymptotic formula for the transition-path time that compares well with simulation data.
Teil des Identifiers:
e-ISSN (online): 0021-9606
Freie Schlagwörter:
Computer simulation
Asymptotic analysis
Chemical physics
DDC-Klassifikation:
530 Physik
Publikationstyp:
Wissenschaftlicher Artikel
Zeitschrift:
The Journal of Chemical Physics
Verlag:
American Institute of Physics (AIP)
Fachbereich/Einrichtung:
Physik
Institut für Theoretische Physik
Anmerkungen:
Die Publikation wurde aus Open Access Publikationsgeldern der Freien Universität Berlin gefördert.