Multiscale simulations of singlet and triplet exciton dynamics in energetically disordered molecular systems based on many-body Green's functions theory

Multiscale simulations of singlet and triplet exciton dynamics in energetically disordered molecular systems based on many-body Green's functions theory

We present a multiscale model based on many-body Green’s functions theory in the GW approximation and the Bethe–Salpeter equation ( GW -BSE) for the simulation of singlet and triplet exciton transport in molecular materials. Dynamics of coupled electron–hole pairs are modeled as a sequence of incohe...

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Bibliographic Details
Main Authors: Jens Wehner, Björn Baumeier
Format: Article
Language:English
Published: IOP Publishing 2020-01-01
Series:New Journal of Physics
Subjects:
multiscale modeling
energy transport
Green's functions
Bethe–Salpeter equation
many-body electronic structure calculations
Online Access:https://doi.org/10.1088/1367-2630/ab7a04

Internet

https://doi.org/10.1088/1367-2630/ab7a04

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