π-π Stacking,Hydrogen Bonding and Magnetic Coupling Mechanism on a Mono-nuclear Cu~Ⅱ Complex

A new mono-nuclear CuII complex [Cu(DPP)(DP)Br](ClO4)H2O (DPP = 2-(3,5- dimethyl-1H-pyrazol-1-yl)-1,10-phenanthroline, DP = 3,5-dimethyl-1H-pyrazole) has been syn- thesized with 2-(3,5-dimethyl-1H-pyrazol-1-yl)-1,10-phenanthroline and 3,5-dimethyl-1H-pyrazole as ligands, and its crystal structure was determined by X-ray crystallography. The crystal is of monoclinic system, space group P21/c with a = 13.765(2), b = 17.044(3), c = 10.9044(16), β= 97.112(2)°, V = 2538.5(6)3, Z = 4, C22H24BrClCuN6O5, Mr = 631.37, Dc = 1.652 g/cm3, F(000) = 1276 and μ= 2.585 mm-1. In the crystal, DPP functions as a tridentate ligand and CuII ions assume a distorted square pyramidal geometry with Br atom lying on the apex, and at the same time, there is π-π stacking between adjacent complexes, which deals with two 1,10-phenanthroline plane rings. In addition to the π-π stacking, there are C-H···Br non-classic hydrogen bonds between adjacent complexes. The theoretical calculations reveal that the π-π stacking and C-H···Br non-classic hydrogen bond result in a weak anti-ferromagnetic interaction with 2J = -5.34 cm-1 and a weak ferromagnetic 2J = 5.92 cm-1, respectively. The magnetic coupling sign from the π-π stacking could be explained with McConnell I spin-polarization mechanism.     

拓扑绝缘基铁磁/铁磁超导隧道结的磁效应和塞曼效应(英文)

运用拓展的BTK理论研究了拓扑绝缘层上铁磁/铁磁超导隧道结的磁效应和塞曼效应,同时考虑了铁磁体和铁磁超导体之间的费米能级错配效应.研究发现:在该系统中塞曼效应和邻近效应可以共存;铁磁体和铁磁超导体之间的费米能级错配效应能够增强系统中发生在eV=Δ处的Andreev谐振散射过程和邻近效应.     

内应力对Mn2NiGa铁磁形状记忆合金的结构、相变和磁性能的影响

通过施加压应力的方法,在铁磁形状记忆合金Mn₂NiGa中引入残留内应力,研究了内应力对 Mn₂NiGa材料的结构、相变和磁性能的影响.研究发现,加压过程使材料发生了塑性形变,在材料内部引入了大量的位错缺陷.卸载后保留的位错缺陷在材料中造成了残留的内应力,导致了马氏体相变温度大幅度提高, 使原本室温下的母相转变成了马氏体相.测量到导致样品转变成马氏体的阈值压应力为1.0 GPa.加压形成的马氏体中的残留内应力将矫顽力从低于50 Oe提高到350 Oe.残留内应力在730 K的热处理中由于位错缺陷的消失而得以消除,样品实现了马氏体逆相变.如此高的逆相变温度使得 Mn₂NiGa马氏体的居里温度测量成为可能,获得了530K的数值.     

Magnetization reversal within Dzyaloshinskii—Moriya interaction under on-site Coulomb interaction in BiCrO3

First-principals calculations show that magnetization reversal is accompanied by the opposite sense of rotation of the neighboring oxygen octahedra along the [1 1 1] direction which is called the antiferrodistortive displacement in BiCrO3. The coupling between magnetization and antiferrodistortive distortion is mainly caused by Dzyaloshinskii- Moriya interaction which is driven by the eg-eg states antiferromagnetic interaction in Cr-3d. A critical value of on-site Coulomb interaction prohibiting the Dzyaloshinskii-Moriya interaction and thus the magnetization reversal is found to be 1.3 eV.     

磁性靶向药物递送中铁磁流体的动力学建模

在所有人体内进行的药物递送技术中,磁性药物靶向递送治疗由于其非入侵性和高靶向性而成为主要的方法．磁性药物靶向递送是将药物装载到磁性纳米颗粒上,利用外部磁场使其移动并聚焦在靶部位的方法．该法能提高靶部位药物的浓度,降低药物对正常组织的毒副作用．尽管已经有不少磁性靶向药物递送的理论分析,但是很少有人研究磁流体在血管里的流体动力学模型．该文提出了一个数学模型来描述作为药物载体的铁磁流体在外磁场作用下,在血管里的流体动力学特性,并在模型中增加了磁场力以及由此产生的不对称应力,增加了磁性纳米颗粒在磁场作用下的角动量方程．由于运动方程的数学复杂性,通过保留数学模型里物理特性最显著项来获得工程近似．用计算流体力学（CFD）进行数值仿真,分析了铁磁流体在一个模拟动脉瘤血管的三维管道里的流动状况,来进一步理解铁磁流体的临床应用．仿真结果和动物实验相一致．分析结果对于磁性靶向药物递送的各种应用提供了可参考的数据．     

Tunneling Conductance in Quantum-Wire/Ferromagnetic-Insulator/d-Wave Superconductor Junction

We have studied the quasiparticle transport in quantum-wire /ferromagnetic-insulator/d wave superconductor Junction (q/FI/d) in the framework of the Blonder-Tinkham-Klapwijk model. We calculate the tunneling conductance in q/FI/d as a function of the bias voltage at zero temperature and finite temperature based on Bogoliubov-de Gennes equations. Different from the case in normal-metal/insulator/d wave superconductor Junctions, the zero-bias conductance peaks vanish for the single-mode case. The tunneling conductance spectra depend on the magnitude of the exchange interaction at the ferromagnetic-insulator.     

基于多齿席夫碱的双核Dy(Ⅲ)配合物的合成、晶体结构和磁性

以2-肟基丙烷酰肼缩2-羟基萘甲醛席夫碱(H2L)为主配体,乙酰丙酮(Hacac)为辅配体,构筑了一例双核稀土镝配合物[Dy2(L)2(acac)2(CH3CH2OH)2](1).通过单晶X射线衍射、元素分析以及磁性测试对其结构和磁行为进行了表征.结构分析表明,配合物1是一个结构呈中心对称的双核镝(Ⅲ)配合物,其结构的...     

铁磁/反铁磁/铁磁三层膜系统中反铁磁自旋结构及其交换各向异性

研究铁磁/反铁磁/铁磁三层膜中界面存在二次以及双二次交换耦合下反铁磁磁矩转动及其交换各向异性.结果表明,其反铁磁膜中的磁矩转动存在可逆"恢复行为"、不可逆"连续倒转行为"以及不可逆"中断倒转行为"三种情形,三种情形的出现强烈地依赖于两界面处的线性耦合和双二次耦合.钉扎界面的交换耦合与旋转界面的交换耦合相互竞争,当钉扎界面耦合占主导时,反铁磁磁矩发生可逆"恢复行为",系统出现交换偏置.在旋转界面耦合占主导情形下,其线性耦合与双二次耦合也相互竞争,分别导致反铁磁磁矩发生不可逆"连续倒转行为"和不可逆"中断倒转行为",系统都不出现交换偏置,但矫顽场都得以增强.相关结论为实验上观测的磁滞能耗以及界面垂直耦合提供了可能的解释.     

Splitting and Restoration of Kondo Peak in a Deformed Molecule Quantum Dot Coupled to Ferromagnetic Electrodes

We adopt the nonequilibrium Green＇s function method to theoretically study the Kondo effect in a deformed molecule, which is treated as an electron-phonon interaction （EPI） system. The self-energy for phonon part is calculated in the standard many-body diagrammatic expansion up to the second order in EPI strength. We find that the multiple phonon-assisted Kondo satellites arise besides the usual Kondo resonance. In the antiparallel magnetic configuration the splitting of main Kondo peak and phonon-assisted satellites only happen for asymmetrical dot-lead couplings, but it is free from the symmetry for the parallel magnetic configuration. The EPI strength and vibrational frequency can enhance the spin splitting of both main Kondo and satellites. It is shown that the suppressed zero-bias Kondo resonance can be restored by applying an external magnetic field, whose magnitude is dependent on the phononic effect remarkably. Although the asymmetry in tunnel coupling has no contribution to the restoration of spin splitting of Kondo peak, it can shrink the external field needed to switch tunneling magnetoresistance ratio between large negative dip and large positive peak.     

谐变磁场激励下非线性铁磁梁式板的共振分叉研究

本文采用磁场计算的磁体力理论模型,对处于均匀横向周期时变磁场中的非线性铁磁悬臂梁式板动力分叉问题进行理论分析和定量研究,首先建立了铁磁悬臂梁式板的非线性动力方程,在此基础上,采用非线性分析的多尺度法研究了铁磁悬壁板的共振分岔,最后,采用Floquet理论研究了该动力系统周期轨道的稳定性问题,数值给出了周期轨道的稳定性区域,Floquet理论研究了该动力系统周期轨道的稳定性问题,数值给出了周期轨道的稳定性区域,并分析了稳定区域与不稳定区域分界线上解的分叉情形。