通过非对称核心异构化在替代受体中优化晶体框架,用于高效的二元有机太阳能电池.
Can Yang1, Qiaoshi An1, Mengyun Jiang1
1Key Laboratory of Cluster Science of Ministry of Education, Beijing Key Laboratory of Photoelectronic/Electrophotonic Conversion Materials, School of Chemistry and Chemical Engineering, Beijing Institute of Technology, Beijing, 100081, China.
Angewandte Chemie (International ed. in English)
|October 12, 2023
概括
研究人员为有机太阳能电池 (OSC) 设计了新型含的小分子受体 (SMA). 优化的A-OSeF分子在二元OSC设备中实现了创纪录的18.5%的功率转换效率.
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:
- 小分子受体 (SMA) 对有机太阳能电池 (OSC) 的效率至关重要.
- 在SMA中,结构性异构化和替代都会影响设备性能.
- 这些修改的协同效应尚未完全理解.
研究的目的:
- 调查SMA中区域性异构化和替代的联合效应.
- 为高效的OSCs开发具有增强性能的新型SMA.
- 为含有的SMA建立结构-属性关系.
主要方法:
- 三种异构体SMAs (S-CSeF,A-ISeF,A-OSeF) 的合成,其位置和异构芳香环的不同.
- 对A-OSeF进行晶体分析,以了解分子包装.
- 使用开发的SMA,制造和表征OSC设备.
- 分析薄膜形态,带隙,结晶性和电荷移动性的分析.
主要成果:
- A-OSeF展示了更紧密的π-π堆叠和更有序的3D网络包装.
- 替代的向外转移导致了更宽的带间隙,更高的晶度和更好的电子流动性.
- PM1:A-OSeF混合物显示出有利的纤维形态,有序的包装和高效的电荷运输.
- 基于A-OSeF的设备在二进制OSC中实现了创纪录的18.5%的功率转换效率.
结论:
- 对位置和异芳环的精确分子工程提供了一种协同方法.
- 优化分子包装和电荷运输是高性能OSC的关键.
- 这项工作为OSC应用开发排名第一的含SMA提供了有前途的战略.
更多相关视频
相关概念视频
Thermal Electrocyclic Reactions: Stereochemistry
2.0K
The stereochemistry of electrocyclic reactions is strongly influenced by the orbital symmetry of the polyene HOMO. Under thermal conditions, the reaction proceeds via the ground-state HOMO.
Selection Rules: Thermal Activation
Conjugated systems containing an even number of π-electron pairs undergo a conrotatory ring closure. For example, thermal electrocyclization of (2E,4E)-2,4-hexadiene, a conjugated diene containing two π-electron pairs, gives trans-3,4-dimethylcyclobutene.
Selection Rules: Thermal Activation
Conjugated systems containing an even number of π-electron pairs undergo a conrotatory ring closure. For example, thermal electrocyclization of (2E,4E)-2,4-hexadiene, a conjugated diene containing two π-electron pairs, gives trans-3,4-dimethylcyclobutene.
2.0K
Thermal and Photochemical Electrocyclic Reactions: Overview
2.4K
Electrocyclic reactions are reversible reactions. They involve an intramolecular cyclization or ring-opening of a conjugated polyene. Shown below are two examples of electrocyclic reactions. In the first reaction, the formation of the cyclic product is favored. In contrast, in the second reaction, ring-opening is favored due to the high ring strain associated with cyclobutene formation.
2.4K
Crystal Field Theory - Octahedral Complexes
26.6K
Crystal Field Theory
To explain the observed behavior of transition metal complexes (such as colors), a model involving electrostatic interactions between the electrons from the ligands and the electrons in the unhybridized d orbitals of the central metal atom has been developed. This electrostatic model is crystal field theory (CFT). It helps to understand, interpret, and predict the colors, magnetic behavior, and some structures of coordination compounds of transition metals.
CFT focuses on...
To explain the observed behavior of transition metal complexes (such as colors), a model involving electrostatic interactions between the electrons from the ligands and the electrons in the unhybridized d orbitals of the central metal atom has been developed. This electrostatic model is crystal field theory (CFT). It helps to understand, interpret, and predict the colors, magnetic behavior, and some structures of coordination compounds of transition metals.
CFT focuses on...
26.6K
Photochemical Electrocyclic Reactions: Stereochemistry
1.8K
The absorption of UV–visible light by conjugated systems causes the promotion of an electron from the ground state to the excited state. Consequently, photochemical electrocyclic reactions proceed via the excited-state HOMO rather than the ground-state HOMO. Since the ground- and excited-state HOMOs have different symmetries, the stereochemical outcome of electrocyclic reactions depends on the mode of activation; i.e., thermal or photochemical.
Selection Rules: Photochemical Activation
Selection Rules: Photochemical Activation
1.8K


