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基于 5,6-二氟苯并噻唑的具有大能带隙和深最高占据分子轨道能级的共轭聚合物。

5,6-Difluorobenzothiazole-Based Conjugated Polymers with Large Band Gaps and Deep Highest Occupied Molecular Orbital Levels.

机构信息

Institute of Polymer Optoelectronic Materials & Devices, State Key Laboratory of Luminescent Materials & Devices , South China University of Technology , Guangzhou 510640 , P. R. China.

School of Materials Science & Engineering , Wuhan Institute of Technology , Wuhan 430205 , P. R. China.

出版信息

ACS Appl Mater Interfaces. 2018 Apr 4;10(13):11094-11100. doi: 10.1021/acsami.8b03643. Epub 2018 Mar 21.

DOI:10.1021/acsami.8b03643
PMID:29533645
Abstract

A 5,6-difluorobenzothiazole-based dibromo monomer was successfully synthesized, from which new fluorinated conjugated polymers PF-ffBTz and PFN-ffBTz were prepared via copolymerizations with two fluorene-based diboronic ester monomers. Twisted fluorene-ffBTz backbones enable PF-ffBTz and PFN-ffBTz with large band gaps up to 3.10 eV and deep-lying highest occupied molecular orbital levels down to -6.2 eV. The chemical structures of PF-ffBTz and PFN-ffBTz impart some new functionalities of fluorinated conjugated polymers. PF-ffBTz can show deep blue electroluminescent emission, with high external quantum efficiency of 3.71%. PFN-ffBTz, with amino-functionalized side chains on the fluorene unit, can serve as an efficient cathode interlayer in inverted polymer solar cells (PSCs), showing better photovoltaic performances if compared with a ZnO interlayer. In addition, it is found that using an optical filter to cut off the short wavelength section (≤380 nm) of incident light can significantly elevate photostability of PSCs under continuous illumination.

摘要

成功合成了一种基于 5,6-二氟苯并噻唑的二溴单体,通过与两种基于芴的二硼酸酯单体的共聚反应,制备了新型氟化共轭聚合物 PF-ffBTz 和 PFN-ffBTz。扭曲的芴-ffBTz 骨架使 PF-ffBTz 和 PFN-ffBTz 具有高达 3.10eV 的大带隙和深达-6.2eV 的最高占据分子轨道能级。PF-ffBTz 和 PFN-ffBTz 的化学结构赋予了氟化共轭聚合物一些新的功能。PF-ffBTz 可以显示深蓝色电致发光发射,外量子效率高达 3.71%。PFN-ffBTz 在芴单元上具有氨基官能化侧链,可用作倒置聚合物太阳能电池 (PSC) 的高效阴极界面层,如果与 ZnO 界面层相比,其光电性能更好。此外,发现使用光学滤波器切断入射光的短波长部分(≤380nm)可以显著提高连续光照下 PSC 的光稳定性。

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