Performance enhancement of block-copolymer solar cells through tapering the donor-acceptor interface: A multiscale Study

Pershin, Anton and Donets, Sergii and Baeurle, Stephan A. (2014) Performance enhancement of block-copolymer solar cells through tapering the donor-acceptor interface: A multiscale Study. POLYMER, 55 (6). pp. 1507-1513. ISSN 0032-3861, 1873-2291

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Abstract

Tapered block copolymers offer an exciting opportunity to tailor the interfacial region between different components by conserving their phase-separated mesoscale structure, which enable the generation of polymer systems with the desired spatio-dynamic properties. Here, we explore their usefulness for optimizing the photovoltaic performance of polymer bulk heterojunctions. To this end, we apply a recently developed particle-based multiscale solar-cell algorithm and investigate the effect of random tapering at the chemical junctions between the electron-donor- (D) and electron-acceptor- (A) blocks on the photovoltaic properties of various lamellar-like polyfluorene-based block-copolymer systems. Our simulation results reveal that introducing a tapered middle block with optimal length leads to a significant increase of the exciton dissociation efficiency, but deteriorates the charge transport efficiency only moderately. This results in a gain of the internal quantum efficiency from 25 up to 39% by increasing the thickness of the active layer of the solar cell from 10 up to 50 nm in direction to the DA interface. (c) 2014 Elsevier Ltd. All rights reserved.

Item Type: Article
Uncontrolled Keywords: POWER CONVERSION EFFICIENCY; PHOTOVOLTAIC DEVICES; ELECTRON-TRANSPORT; FORCE-FIELD; POLYMER; SIMULATION; KINETICS; Photovoltaic performance of polymer bulk; heterojunctions; Tapering of donor-acceptor interface; Multiscale modeling study
Subjects: 500 Science > 540 Chemistry & allied sciences
Divisions: Chemistry and Pharmacy > Institut für Physikalische und Theoretische Chemie
Depositing User: Dr. Gernot Deinzer
Date Deposited: 15 Nov 2019 13:38
Last Modified: 15 Nov 2019 13:38
URI: https://pred.uni-regensburg.de/id/eprint/10453

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