调查佐狄欧芬 - 异青共聚物中的聚合类型
Eninges Asmare1, Fekadu Gashaw Hone1, Wendimagegn Mammo2
1Department of Physics, Addis Ababa University, Addis Ababa 1176, Ethiopia.
The Journal of chemical physics
|July 17, 2023
概括
结合聚合物的聚合会影响电子设备的性能. 这项研究在PBDTI-DT中发现了H型和J型聚合物,其中H型聚合物占主导地位,表明它适合用于太阳能电池.
科学领域:
- 材料科学 材料科学 材料科学
- 聚合物化学 聚合物化学
- 有机电子 有机电子
背景情况:
- 合聚合物的聚合行为对于它们的光电子特性至关重要.
- 对于太阳能电池而言,H型聚合物是最佳的,而J型聚合物则是发光二极管的首选.
研究的目的:
- 为了确定佐狄芬-异基 (PBDTI-DT) 共聚物中存在的聚合类型.
- 为了将聚合类型与电子设备中的潜在应用联系起来.
主要方法:
- 利用黄瑞斯因子进化与温度.
- 进行了弗兰克-康登分析.
- 计算的相对量子收益率 (QY).
- 采用时间依赖密度函数理论 (TD-DFT) 进行光谱分析.
主要成果:
- 这三种实验方法都表明存在H型和J型聚合物.
- 相对量子产量计算表明,H-聚合物在PBDTI-DT共聚合物中占主导地位.
- TD-DFT确定了两个吸收带,归因于局部π - π*和分子内电荷转移过渡.
结论:
- PBDTI-DT共聚合物表现出混合的聚合类型,其中H聚合物占主导地位.
- 这些发现表明,由于H聚合占主导地位,PBDTI-DT在太阳能电池应用中存在潜在的PBDTI-DT.
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