对于全小分子有机太阳能电池的热的相场模拟
Yasin Ameslon1, Olivier J J Ronsin1, Christina Harreiß2
1Helmholtz Institute Erlangen-Nürnberg for Renewable Energy, Forschungszentrum Jülich, Fürther Strasse 248, 90429 Nürnberg, Germany. y.ameslon@fz-juelich.de.
Physical chemistry chemical physics : PCCP
|January 6, 2025
概括
有机太阳能电池 (OSCs) 的热影响了批量异质连接 (BHJ) 的纳米形态. 模拟显示,化过程中的晶体溶解和生长是优化BHJ形态以提高设备性能的关键.
科学领域:
- 材料科学 材料科学 材料科学
- 有机电子 有机电子
- 太阳能光伏发电是如何实现的
背景情况:
- 有机太阳能电池 (OSC) 正在成为光伏设备的兴趣.
- 设备性能严重依赖于批量异质连接 (BHJ) 纳米形态.
- 在干燥和后处理过程中,BHJ的纳米形态发展.
研究的目的:
- 为了研究热 (TA) 对DRCN5T:PC71BM混合物的影响.
- 了解在TA期间推动BHJ形态演变的物理现象.
- 阐明OSCs治疗后和形态之间的关系.
主要方法:
- 使用相场模拟来建模DRCN5T:PC71BM混合物.
- 研究的DRCN5T结晶机制:核化,生长,稳定性,撞击,谷物粗化和奥斯瓦尔德成熟.
- 分析无形-无形相分离 (AAPS) 和扩散限制.
主要成果:
- 模拟结果与实验数据进行了比较.
- 在TA下的形态进化主要是由不稳定的小DRCN5T晶体的溶解.
- 观察到较大的DRCN5T晶体的异型生长.
结论:
- 热显著影响OSC的BHJ纳米形态.
- 了解晶体溶解和异型生长对于优化OSC至关重要.
- 阶段场模拟为治疗后/形态关系提供了宝贵的见解.
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