Na(1.5) Ag(1.5) MO3F3 (M = Mo,W):是LiNbO3结构的一个有序的氧化物衍生物
Allyson M Fry1, Harry A Seibel, Indunil N Lokuhewa
1Department of Chemistry, The Ohio State University, Columbus, Ohio 43210-1185, USA.
Journal of the American Chemical Society
|December 23, 2011
概括
新的极性氧化材料,Na(1.5) Ag(1.5) MoO(3) F(3) 和Na(1.5) Ag(1.5) WO(3) F(3),表现出有序的结构. 这种/银离子和氧化基的排序为设计极性材料提供了一条新途径.
科学领域:
- 固态化学 固态化学
- 材料科学 是一种材料科学.
- 晶体学 晶体学是指结晶学.
背景情况:
- [MO(3) F(3) ](3-) 离子 (M = Mo,W) 通常在晶体盐中表现出方向障碍.
- 开发具有定制性质的新极性材料是材料科学的持续挑战.
研究的目的:
- 合成和描述具有潜在独特结构和极性质的新型银氧化.
- 调查阴离子选择在指导极性氧化化离子排序中的作用.
主要方法:
- 固态合成反应被用来制备目标化合物.
- 用同步射线X射线和中子粉衍射技术进行了详细的结构特征.
主要成果:
- 纳1.5) Ag1.5) MoO3) F3) 和纳1.5) Ag1.5) WO3) F3) 已成功合成并从结构上阐明.
- 发现了一种新型结构类型,其特点是[MO(3) F(3) ](3-) 离子的方向排序.
- 和银离子显示出明显的协调偏好 (分别是和氧),驱动观察到的顺序.
结论:
- /离子排序和离子定向排序的结合导致了具有减少对称性的超细胞结构 (R3).
- 这项工作提出了一种新的策略,用于设计极性材料,利用硬和软的离子来控制极性建筑单元的排列.
相关概念视频
Ionic Crystal Structures
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...
Lewis Structures of Molecular Compounds and Polyatomic Ions
To draw Lewis structures for complicated molecules and molecular ions, it is helpful to follow a step-by-step procedure as outlined:
Valence Bond Theory
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...
Hybridization of Atomic Orbitals I
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...
MO Theory and Covalent Bonding
The molecular orbital theory describes the distribution of electrons in molecules in a manner similar to the distribution of electrons in atomic orbitals. The region of space in which a valence electron in a molecule is likely to be found is called a molecular orbital. Mathematically, the linear combination of atomic orbitals (LCAO) generates molecular orbitals. Combinations of in-phase atomic orbital wave functions result in regions with a high probability of electron density, while...
VSEPR Theory and the Basic Shapes
Overview of VSEPR Theory


