基于DPP、均四嗪有机小分子染料敏化剂的理论模拟、合成及光电性能分析-有机化学专业论文.docxVIP

聊城大学硕士学位论文 聊城大学硕士学位论文 PAGE PAGE iii ABSTRACT Traditional non-renewable fossil fuels is bound to draw attention to new energy exploration and development, as a new, cheap and environmental protection, dye sensitized solar cells (DSSC) is becoming a hot spot of research in recent years. How to obtain high photoelectric conversion efficiency, not only relate to the DSSC production conditions and process, but also closely linked with the type of sensitizers. This paper reviews the research progress of phthalocyanine sensitizer, designed three kinds of different dye sensitizers, through theoretical calculation, verify its feasibility as a sensitizer, and further synthesis and simple characterization. This paper is supported by the National Basic Research Program of China (Grant No. 2011CBA00701) and National Nature Science Foundation of China (Grant No. Some valuing and significant results were obtained in the following subjects. The first chapter briefly describes the history of solar power, DSSC structure and the working principle. The current situation of the sensitizer in recent years are briefly summarized and several structures of efficient sensitizer are listed, especially for DPP sensitizer. In chapter 2, six senseitizers containing diketopyrrolopyrrole was designed and synthesized, named PaDPP-1 - PaDPP-3 and PtDPP-1 - PtDPP-3. The molecular orbital energy level and the special distribution of the molecular orbital were calculated by Density functional theory (DFT) with LANL2DZ. Discussed the influence of DPP sensitizers contain different donor and acceptor. The theoretical calculation found that PaDPP has a higher HOMO-LUMO gap compared to PtDPP. And further measured UV-Vis absorbtion spectrum and fluorescence spectrum in chloroform, with rhodanine-N-acetic acid as the sensitized adsorption group agent than with cyanoacrylate absorb more redshift, the largest visible PaDPP sensitizer absorbed more than 600nm. The DPP Which Use Rhodanine-N-acetic ac