染料敏化太阳能电池中的电子转移和染料再生

2018 International Semiconductor Conference (CAS) Pub Date : 2018-10-01 DOI:10.1109/SMICND.2018.8539783

C. Oprea, A. Ndiaye, A. Trandafir, F. Cimpoesu, Mihai A. Cîrţu

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引用次数: 0

摘要

我们报告了一项计算研究的结果，以了解有机染料与钴(II)配合物的染料再生机制。通过密度泛函理论计算各种染料电解质构型的能量，我们可以确定Marcus电子转移理论的参数。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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Electron Transfer and Dye Regeneration in Dye-Sensitized Solar Cells

We report results of a computational study to understand the dye regeneration mechanism of organic dyes in conjunction with cobalt(II) complexes. We are able to determine the parameters of Marcus' theory for electron transfer by means of density functional theory calculations of the energy in various dye-electrolyte configurations.

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2018 International Semiconductor Conference (CAS)

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