化学化揭示了合四二碳酸盐的结构
Kieran Griffiths1,2, Chris Cook1,2, Valerie R Seymour1,2
1Department of Chemistry, Lancaster University, Lancaster, LA1 4YB, UK. j.griffin@lancaster.ac.uk.
概括
研究人员解决了化金属二碳酸盐的晶体结构,这对于开发新的可充电电池阳极材料至关重要. 这项工作显示,在放电过程中,离子在结构内完全混合.
科学领域:
- 材料科学 材料科学 材料科学
- 电化学 电化学 电化学
- 晶体学 晶体学是指结晶学.
背景情况:
- 合金属二碳酸盐对于可充电电池阳极具有前景.
- 它们的减少 (放电) 阶段的晶体结构尚不清楚.
研究的目的:
- 为了确定减少的四二碳酸盐的晶体结构.
- 为了比较通过化学和电化学化获得的结构.
主要方法:
- 化学化被用来合成减少的相.
- 使用X射线晶体学来解决晶体结构.
- 进行了固态核磁共振 (NMR) 和密度函数理论 (DFT) 的计算.
主要成果:
- 两种四二碳酸盐的晶体结构首次得到解决.
- 这些结构与电化学化过程中形成的结构相同.
- 在间隔时观察到离子的完全混合.
结论:
- 这项研究阐明了金属二碳酸电池材料中关键放电相的结构.
- 这些发现证实了化学和电化学还原途径之间的结构等价性.
- 了解阴离子混合对于优化可充电电池的阳极性能至关重要.
更多相关视频
09:45Accessing Valuable Ligand Supports for Transition Metals: A Modified, Intermediate Scale Preparation of 1,2,3,4,5-Pentamethylcyclopentadiene
Published on: March 20, 2017
10.6K
06:561,3,5-Triphenylbenzene and Corannulene as Electron Receptors for Lithium Solvated Electron Solutions
Published on: October 10, 2016
7.8K
相关概念视频
Predicting Molecular Geometry
36.2K
VSEPR Theory for Determination of Electron Pair Geometries
36.2K
Crystal Field Theory - Tetrahedral and Square Planar Complexes
44.8K
Tetrahedral Complexes
Crystal field theory (CFT) is applicable to molecules in geometries other than octahedral. In octahedral complexes, the lobes of the dx2−y2 and dz2 orbitals point directly at the ligands. For tetrahedral complexes, the d orbitals remain in place, but with only four ligands located between the axes. None of the orbitals points directly at the tetrahedral ligands. However, the dx2−y2 and dz2 orbitals (along the Cartesian axes) overlap with the ligands less than the dxy,...
Crystal field theory (CFT) is applicable to molecules in geometries other than octahedral. In octahedral complexes, the lobes of the dx2−y2 and dz2 orbitals point directly at the ligands. For tetrahedral complexes, the d orbitals remain in place, but with only four ligands located between the axes. None of the orbitals points directly at the tetrahedral ligands. However, the dx2−y2 and dz2 orbitals (along the Cartesian axes) overlap with the ligands less than the dxy,...
44.8K
Ionic Crystal Structures
14.8K
Ionic crystals consist of two or more different kinds of ions that usually have different sizes. The packing of these ions into a crystal structure is more complex than the packing of metal atoms that are the same size.
Most monatomic ions behave as charged spheres, and their attraction for ions of opposite charge is the same in every direction. Consequently, stable structures for ionic compounds result (1) when ions of one charge are surrounded by as many ions as possible of the opposite...
Most monatomic ions behave as charged spheres, and their attraction for ions of opposite charge is the same in every direction. Consequently, stable structures for ionic compounds result (1) when ions of one charge are surrounded by as many ions as possible of the opposite...
14.8K
Ionic Bonding and Electron Transfer
42.4K
Ions are atoms or molecules bearing an electrical charge. A cation (a positive ion) forms when a neutral atom loses one or more electrons from its valence shell, and an anion (a negative ion) forms when a neutral atom gains one or more electrons in its valence shell. Compounds composed of ions are called ionic compounds (or salts), and their constituent ions are held together by ionic bonds: electrostatic forces of attraction between oppositely charged cations and anions.
42.4K
Valence Bond Theory
9.7K
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...
9.7K
Metal-Ligand Bonds
21.5K
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...
21.5K
