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Title:

Generalized Kinetic Monte Carlo Framework for Organic Electronics

Document type:
Zeitschriftenaufsatz
Author(s):
Kaiser, W.; Popp, J.; Rinderle, M.; Albes, T.; Gagliardi, A.
Abstract:
In this paper, we present our generalized kinetic Monte Carlo (kMC) framework for the simulation of organic semiconductors and electronic devices such as solar cells (OSCs) and light-emitting diodes (OLEDs). Our model generalizes the geometrical representation of the multifaceted properties of the organic material by the use of a non-cubic, generalized Voronoi tessellation and a model that connects sites to polymer chains. Herewith, we obtain a realistic model for both amorphous and crystalline...     »
Keywords:
kinetic Monte Carlo; organic semiconductors; Voronoi tessellation; polymer chains; excitonic processes
Journal title:
Algorithms 11(4), 37 (This article belongs to the Special Issue Monte Carlo Methods and Algorithms) 2018-03
Year:
2018
Year / month:
2018-03
Quarter:
1. Quartal
Month:
Mar
Pages contribution:
37
Language:
en
Fulltext / DOI:
doi:10.3390/a11040037
WWW:
http://www.mdpi.com/1999-4893/11/4/37
Publisher:
MDPI AG, Basel, Switzerland
E-ISSN:
1999-4893
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