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Electronic structure in hybrid nanocomposit

机译:杂化纳米复合材料的电子结构

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Modern optoelectronic devices based on hybrid nanocomposite thin films composed of inorganic colloidal quantum dots (CQDs) embedded in an organic conjugated polymer have attracted much scientific attention. The CQDs are solution phase processed nanostructure which are coated with a surface ligand material that is comprised of short, organic molecules to prevent the CQDs from aggregation when placed in solution. These surface ligand materials behave as a thin, insulating layer that has been shown to prevent efficient transfer of excited carriers into and out of the CQD. Therefore, it is important to understand the effect that the surface ligand material has on the optical properties of the nanocomposite materials in order to design more efficient hybrid nanocomposite optoelectronic devices. In this paper, we present a method for calculating the electronic structure such as intraband energy levels and wave functions for CQDs in a nanocomposite thin film structure. The model is verified by comparing the results to reported data in literature. The model which is based on matrix method, causes simplicity in calculation and can easily be applied for more complicated structures.
机译:基于由嵌入有机共轭聚合物中的无机胶体量子点(CQD)组成的杂化纳米复合薄膜的现代光电器件吸引了许多科学关注。 CQD是溶液相处理的纳米结构,其表面涂覆有由短有机分子组成的表面配体材料,以防止当放置在溶液中时CQD聚集。这些表面配体材料表现为薄的绝缘层,已证明可防止激发的载流子有效转移到CQD中和从CQD中转移出来。因此,重要的是要了解表面配体材料对纳米复合材料的光学性能的影响,以便设计出更有效的混合纳米复合光电器件。在本文中,我们提出了一种计算电子结构的方法,例如纳米复合薄膜结构中CQD的带内能级和波函数。通过将结果与文献中报道的数据进行比较,可以验证该模型。该模型基于矩阵方法,简化了计算,可以轻松地应用于更复杂的结构。

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