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控制,和的二维金属半体框架中的电子结构和导电性
Michael E Ziebel1, Lucy E Darago1, Jeffrey R Long1,2,3
1Department of Chemistry, University of California , Berkeley, California 94720, United States.
Journal of the American Chemical Society
|February 6, 2018
概括
新的金属有机框架显示可调节的电子导电性. 基于的材料由于强烈的金属连接物相互作用而表现出高导电性,为电荷传输机制提供了洞察力.
科学领域:
- 材料科学
- 固态化学
- 协调化学
背景情况:
- 对二维金属有机框架 (MOF) 的电子特性进行了研究.
- 合成了具有不同金属中心 (Ti,V,Cr) 和联结体 (Cl2dhbq,dhbq) 的同结构MOF.
研究的目的:
- 合成和描述新的同结构二维MOF.
- 调查电子结构,金属配体共振性和电子导电性之间的关系.
- 了解混合价值框架中的电荷传输机制.
主要方法:
- 光谱方法 (UV对NIR,IR)
- 磁性测量
- 电化学分析
- 分子轨道计算
主要成果:
- 合成了 (H2NMe2) 2M2 ((Cl2dhbq) 3 (M=Ti,V) 和 (H2NMe2) 1.5Cr2 ((dhbq) 3) 的化合物.
- 在电子结构和导电性方面观察到显著的差异.
- 相显示高电子导电率 (0.45 S/cm) 由于金属联体共价,自旋火和同时的氧化还原过程.
结论:
- 这些MOF中的电子导电性与电子移位相关.
- 电荷转移的间隔和金属合物的能量调整决定了电荷跳跃的障碍.
- 这些发现为设计导电MOF提供了框架.
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