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Structure control of poly(p-phenylene vinylene) in layer-by-layer films by deposition on a charged poly(o-methoxyaniline) cushion

机译:通过沉积在带电聚(邻甲氧基苯胺)垫上的逐层薄膜中聚(对亚苯基亚乙烯基)的结构控制

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摘要

In this paper, we demonstrate that the intrinsic electric field created by a poly(o-methoxyaniline) (POMA) cushion layer hinders the changes in molecular conformation of poly(p-phenylenevinylene) (PPV) in layer-by-layer with dodecylbenzene sulfonic acid (DBS). This was modeled with density functional theory (DFT) calculations where an energy barrier hampered molecular movements of PPV segments when theywere subjected to an electric field comparable to that caused by a charged POMA layer. With restricted changes in molecular conformation, the PPV film exhibited Franck-Condon transitions and the photoexcitation spectra resembled the absorption spectra, in contrast to PPV/DBS films deposited directly on glass, with no POMA cushion. Other effects from the POMA cushion were the reduced number of structural defects, confirmed with Raman spectroscopy, and an enhanced PPV emission at high temperatures (300 K) in comparison with the films on bare glass. The positive effects from the POMA cushion may be exploited for enhanced opto-electronic devices, especially as the intrinsic electric field may assist in separating photoexcited electron-hole pairs in photovoltaic devices.
机译:在本文中,我们证明了聚(邻甲氧基苯胺)(POMA)缓冲层产生的固有电场阻碍了十二烷基苯磺酸逐层地改变聚对苯撑乙烯撑(PPV)分子构象的变化。酸(DBS)。这是用密度泛函理论(DFT)计算建模的,其中当能量通过PPV链段时,能垒会阻碍PPV链段的分子运动,而电场应与带电的POMA层引起的电场相当。与直接沉积在玻璃上且没有POMA缓冲层的PPV / DBS膜相比,在分子构象变化受限的情况下,PPV膜表现出Franck-Condon跃迁,并且光激发光谱类似于吸收光谱。与裸玻璃上的膜相比,POMA缓冲垫的其他作用还包括减少的结构缺陷数量(已通过拉曼光谱法确认)以及在高温(300 K)下增强的PPV发射。 POMA缓冲垫的积极作用可用于增强型光电设备,尤其是因为固有电场可帮助分离光伏设备中的光激发电子-空穴对。

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