在BaFe2(PO4) 2中的结构回流过渡过程中:二维铁磁的影响
Rénald David1, Alain Pautrat, Dmitry Filimonov
1Université Lille Nord de France, UCCS, UMR-CNRS 8181, ENSCL-USTL, Villeneuve d'Ascq, France.
Journal of the American Chemical Society
|August 24, 2013
概括
酸铁,BaFe2(PO4) 2,是第一个2D Ising铁磁氧化物. 它表现出一个独特的回入结构过渡接近其库里温度,由磁性排序和Jahn-Teller不稳定性驱动.
科学领域:
- 材料科学 材料科学 材料科学
- 固态物理 固态物理
- 磁力学 磁力学 是一种
背景情况:
- 二维 (2D) 材料提供独特的物理特性,由于减少了维度.
- 具有磁性排序的氧化物材料对自旋电子应用具有重大兴趣.
- 氧化物中的铁磁性是罕见的,这使得新的发现非常有价值.
研究的目的:
- 合成和描述BaFe2(PO4)2作为一种新的2D Ising铁磁氧化物.
- 为了研究BaFe2的结构和磁性相位过渡, BaFe2(PO4)2.2.
- 了解晶体结构,Jahn-Teller扭曲和磁性质之间的相互作用.
主要方法:
- 用于材料制备的热水合成.
- 用X射线衍射来确定晶体结构.
- 莫斯巴乌尔光谱和电子磁共振 (EPR) 用于磁性表征.
- 密度函数理论 (DFT) 计算用于能源估计.
主要成果:
- BaFe2(PO4)2被确定为第一个2D Ising铁磁氧化物,具有FeO6八面体的蜂层.
- 从三角向三临床 (P-1) 的结构过渡发生在140K以下,这是由于Jahn-Teller的不稳定性.
- 在70K以下观察到一种罕见的重返性结构过渡到三角形 (R-3),与铁磁排序 (Tc = 65.5K) 相吻合.
- 莫斯巴乌尔光谱学揭示了四极分裂中不连续的变化,与结构转变相关.
- EPR证实了单轴磁性异构性和Tc.以上磁域的存在.
结论:
- BaFe2(PO4)2 呈现出 Jahn-Teller 扭曲和二维 Ising 铁磁之间的复杂相互作用.
- 重返的结构转变是一种与磁性排序相关的独特现象.
- 这种材料可以作为研究氧化物中二维Ising磁性的模型系统.
更多相关视频
09:06Visualizing Uniaxial-strain Manipulation of Antiferromagnetic Domains in Fe1+YTe Using a Spin-polarized Scanning Tunneling Microscope
Published on: March 24, 2019
08:55Methods of Ex Situ and In Situ Investigations of Structural Transformations: The Case of Crystallization of Metallic Glasses
Published on: June 7, 2018
相关概念视频
Ferromagnetism
Materials like iron, nickel, and cobalt consist of magnetic domains, within which the magnetic dipoles are arranged parallel to each other. The magnetic dipoles are rigidly aligned in the same direction within a domain by quantum mechanical coupling among the atoms. This coupling is so strong that even thermal agitation at room temperature cannot break it. The result is that each domain has a net dipole moment. However, some materials have weaker coupling, and are ferromagnetic at lower...
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...
Crystal Field Theory - Tetrahedral and Square Planar Complexes
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,...
Coordination Number and Geometry
For transition metal complexes, the coordination number determines the geometry around the central metal ion. Table 1 compares coordination numbers to molecular geometry. The most common structures of the complexes in coordination compounds are octahedral, tetrahedral, and square planar.
Colors and Magnetism
Color in Coordination Complexes
When atoms or molecules absorb light at the proper frequency, their electrons are excited to higher-energy orbitals. For many main group atoms and molecules, the absorbed photons are in the ultraviolet range of the electromagnetic spectrum, which cannot be detected by the human eye. For coordination compounds, the energy difference between the d orbitals often allows photons in the visible range to be absorbed and emitted, which is seen as colors by the human eye.
When atoms or molecules absorb light at the proper frequency, their electrons are excited to higher-energy orbitals. For many main group atoms and molecules, the absorbed photons are in the ultraviolet range of the electromagnetic spectrum, which cannot be detected by the human eye. For coordination compounds, the energy difference between the d orbitals often allows photons in the visible range to be absorbed and emitted, which is seen as colors by the human eye.
