提供者和接受者的轨道杂交,以提高混合堆复合物的导电性
Tomoko Fujino1, Ryohei Kameyama2, Kota Onozuka2
1The Institute for Solid State Physics, The University of Tokyo, 5-1-5 Kashiwanoha, Kashiwa, Chiba, 277-8581, Japan. fujino@issp.u-tokyo.ac.jp.
Nature communications
|April 16, 2024
概括
研究人员合成了新的中性离子边界有机导体. 由于独特的轨道杂交,这些材料表现出增强的导电性,在单晶混合堆复合体中达到创纪录的水平.
科学领域:
- 材料科学 材料科学 材料科学
- 有机电子 有机电子
- 固态化学 固态化学
背景情况:
- 混合堆复合体通常由于中性或离子状态导致导电性差,限制电荷载体.
- 在有机导体中实现高导电性需要克服电荷局部化.
研究的目的:
- 在中性离子边界合成新的混合堆复合物.
- 研究这些独特材料中电子结构和导电性之间的关系.
主要方法:
- 使用 bis ((3,4-乙烯二甲基甲基诺提奥芬) 和化四氨基二甲胺的捐赠体-接受体复合物的合成.
- 单晶复合物的表征,以分析轨道杂交和电子性质.
主要成果:
- 实现了独特的中性离子边界复合体,具有高度混合的轨道.
- 在单晶混合堆复合体中观察到增强的室温导电性 (10−40.1 S cm−1).
- 在环境条件下报告了单晶混合堆复合体的最高导电性.
结论:
- 在中性离子边界的轨道杂交显著提高有机材料的导电性.
- 独特的电子结构导致物理性质与温度的突然变化.
- 这些发现为设计高性能有机导体开辟了新的途径.
相关概念视频
Valence Bond Theory
8.5K
Coordination compounds and complexes exhibit different colors, geometries, and magnetic behavior, depending on the metal atom/ion and ligands from which they are composed. In an attempt to explain the bonding and structure of coordination complexes, Linus Pauling proposed the valence bond theory, or VBT, using the concepts of hybridization and the overlapping of the atomic orbitals. According to VBT, the central metal atom or ion (Lewis acid) hybridizes to provide empty orbitals of suitable...
8.5K
Hybridization of Atomic Orbitals I
47.0K
The mathematical expression known as the wave function, ψ, contains information about each orbital and the wavelike properties of electrons in an isolated atom. When atoms are bound together in a molecule, the wave functions combine to produce new mathematical descriptions that have different shapes. This process of combining the wave functions for atomic orbitals is called hybridization and is mathematically accomplished by the linear combination of atomic orbitals. The new orbitals that...
47.0K
Complexation Equilibria: The Chelate Effect
513
In complexation reactions, metal atoms or cations interact with ligands to form donor-acceptor adducts called metal complexes. Ligands that bind through one donor site are monodentate, ligands with two donor sites are bidentate, and those with more than two donor sites are polydentate ligands. For example, ethylene diamine is a bidentate ligand that binds through two nitrogen donor atoms, forming a five-membered ring. EDTA is a polydentate ligand that binds through four oxygen and two nitrogen...
513
Metal-Ligand Bonds
20.7K
The hemoglobin in the blood, the chlorophyll in green plants, vitamin B-12, and the catalyst used in the manufacture of polyethylene all contain coordination compounds. Ions of the metals, especially the transition metals, are likely to form complexes.
In these complexes, transition metals form coordinate covalent bonds, a kind of Lewis acid-base interaction in which both of the electrons in the bond are contributed by a donor (Lewis base) to an electron acceptor (Lewis acid). The Lewis acid in...
In these complexes, transition metals form coordinate covalent bonds, a kind of Lewis acid-base interaction in which both of the electrons in the bond are contributed by a donor (Lewis base) to an electron acceptor (Lewis acid). The Lewis acid in...
20.7K
Valence Bond Theory and Hybridized Orbitals
19.3K
According to valence bond theory, a covalent bond results when: (1) an orbital on one atom overlaps an orbital on a second atom, and (2) the single electrons in each orbital combine to form an electron pair. The strength of a covalent bond depends on the extent of overlap of the orbitals involved. Maximum overlap is possible when the orbitals overlap on a direct line between the two nuclei.
A σ bond (single bond in a Lewis structure) is a covalent bond in which the electron density is...
A σ bond (single bond in a Lewis structure) is a covalent bond in which the electron density is...
19.3K
Hybridization of Atomic Orbitals II
32.2K
sp3d and sp3d 2 Hybridization
32.2K


