Nd_2Fe_14_B化合物磁晶各向异性起源的理论研究

本文根据Nd_2Fe_14_B化合物中存有少量巡游电子的基本实验事实, 提出了在Nd_2Fe_14_B 中配位子所产生的晶场和巡游申子所产生的电场共同造成了N d 离子磁犯各向异性的理沦模型.提出并解决了计算巡游电子同中心Nd 离子相互作用的理论方法.在同时考虑Nd 离子所受配位子的晶场和巡游电子的电场的作用情况下, 用单离子模型计算了Nd_2Fe_14_B中Nd 离子所产生的磁晶各向异性及其随温度的变化. 所得的K-T , K-T 关系与实验符合得很好. 这一结果还同时解释了这种材料在低温下所存在的自旋重取向现象.人此可以认为, 这一模型本上揭示了Nd_2Fe_14_B 中Nd 离子磁品各向异性的起源。 关键词：     

取向Pr2Fe14B与Nd2Fe14B多晶磁化曲线的 计算

基于单离子晶场模型,提出了计算稀土-Fe(Co)金属间化合物取向多晶样品磁化曲线的方法.用此方法计算了取向Pr₂Fe₁₄B和Nd₂Fe₁₄ B多晶的高场磁化曲线,计算中使用了拟合化合物单晶磁化曲线得到的交换场与晶场参数.计 算曲线与实验曲线相符合. 关键词： 磁化曲线 晶场 2Fe₁₄B')" href="#">R₂Fe₁₄B     

R2Fe14B型永磁材料中第二磁晶各向异性常数对反磁化过程的影响

针对低温下各向同性Pr₂Fe₁₄B永磁材料的最小形核场问题，用数值 计算法和近似解 析解研究了第二磁晶各向异性常数K₂对最小形核场的影响.研究发现，尽管对于 Nd₂ Fe₁₄B永磁材料一级近似的解析解与数值计算结果很接近，但是对于低温下各向 同性P r₂Fe₁₄B永磁材料则至少要用二级近似下的解析解才能与数值计算 结果相接近.用有 关最小形核场的计算结果很好地解释了低温时各向同性Pr₂Fe₁₄B永 磁材料的矫顽力与最小形核场的关系. 关键词： 第二磁晶各向异性常数 形核场 矫顽力     

R2Fe14B(R=Ce,Pr,Gd)磁晶各向异性常数K1,K2随温度的变化

本文在1.5—300K温度范围内测量了R₂Fe₁₄B(R=Ce,Pr,Gd)各向异性常数K₁,K₂和各向异性场H_A随温度的变化。同时用单离子模型计算了Pr³⁺离子对Pr₂Fe₁₄B磁晶各向异性的贡献,得到与实验值半定量符合的结果。 关键词：     

Nd2Fe14B的价电子结构分析和磁性计算

应用固体与分子经验电子理论计算了Nd₂Fe₁₄B的价电子结构、磁矩和居里温度,计算结果与实验值相符.计算表明:该合金的磁性与3d磁电子数成正比.从Fe(c)晶位到Fe(k₂)晶位磁矩增加,其机理源于价电子、哑对电子和3d磁电子之间的转化,有78%的哑对电子和18%的3d共价电子转化成了磁电子.居里温度和磁矩与Fe原子配位数成正比,与加权等同键数I^σ成反比,Nd原子 关键词： 2Fe₁₄B')" href="#">Nd₂Fe₁₄B 价电子结构 居里温度     

复相Nd4.5Fe76.3Ga0.3Co1.0B18合金的结构与磁性

利用快淬法制备了Nd_4.5Fe_76.3Ga_0.3Co_1.0B₁₈非晶合金,晶化处理后获得主相为Fe₃B与Nd₂Fe₁₄B的纳米晶永磁材料.采用X射线衍射、透射电子显微镜及磁测量手段分析研究了材料的微观结构与磁性能,并通过测量磁体的δM曲线,研究了晶粒间的交换耦合作用及其与微观结构、磁性能的关系. 关键词：     

Ti掺杂Nd2Fe14B/α-Fe纳米双相复合永磁体晶化动力学

纳米双相复合稀土永磁材料,利用硬磁相高磁晶各向异性和软磁相高饱和磁化强度的优点,通过铁磁交换耦合作用获得优异的磁性能.但是如何解决软硬磁双相纳米微结构不匹配的问题,控制软硬磁相同时达到理想的纳米尺度复合是关键.本文研究了掺杂合金元素Ti对熔体快淬法制备的Nd₂Fe₁₄B/α-Fe快淬薄带晶化过程的影响.结果表明,掺杂合金元素Ti能影响Nd₂Fe₁₄B/α-Fe交换耦合磁体整个晶化动力学过程,使α-Fe相的晶化激活能升高,抑制其从非晶相中析出.同时,降低1∶7亚稳相的晶化激活能,起到稳定亚稳相的作用.而且随着晶化温度的进一步提高, α-Fe和Nd₂Fe₁₄B两相由1∶7亚稳相分解产生,从而有效避免了α-Fe相的优先析出.显微组织观察表明,掺杂Ti的样品晶粒细小、分布均匀,平均晶粒尺寸在20 nm左右,没有特别大的α-Fe粒子出现.当Ti的掺杂量原子百分数为1.0%时,获得了最佳磁性能(BH)_max=12 MG·Oe(1 G=10     

Dy在Nd2Fe14B晶格中的占位及其对Fe原子磁矩影响的第一性原理计算

基于第一性原理投影缀加波和梯度矫正局域密度近似(PAW-GGA), 研究了Nd₂Fe₁₄B和Dy₂Fe₁₄B的基态晶格属性, 进而对Dy在Nd₂Fe₁₄B晶格中的掺杂进行了研究, 并采用GGA+U的方式进行了原子磁矩计算, 并与自旋轨道耦合 (SOI) 计算结果进行了对照. 置换计算表明, Dy原子倾向于置换Nd₂Fe₁₄B晶格中4f位的稀土原子. 磁矩计算表明, 在R₂Fe₁₄B (R: 稀土元素) 晶格中, 4f位的稀土元素与Fe原子作用更强, 对磁性能的影响更大. 稀土原子与Fe的作用与距离呈正相关. 关键词： 2Fe₁₄B')" href="#">Nd₂Fe₁₄B 晶格占位 形成能 原子磁矩     

热处理对非晶态合金Nd4Fe96-xBx磁性的影响

本文研究了用单辊急冷方法制备的非晶态合金Nd₄Fe_96-xB_x的晶化,以及热处理对其硬磁性和相组成的影响,发现非晶态合金Nd₄Fe_96-xB_x的晶化温度比相同B含量的非晶态合金Fe_100-xB_x高120—190K,X射线衍射和热磁测量表明,15≤x≤25的样品晶化相是由Nd₂Fe₁₄B(T 关键词：     

Si对Nd2Fe14B四方相结构和磁性的影响

本文对Si加入Nd₂Fe₁₄B四方相后所形成的合金相的结构和磁性进行了研究。结果表明,Si加入Nd₂Fe₁₄B四方相后并不破坏它的结构(Si的含量可达B的两倍),而形成Nd₂(Fe,Si)₁₄B赝三元金属间化合物。随着Si含量的增加,晶格常数和饱和磁化强度随之减小,但居里温度则随之增加。Si的加入,并不改变Nd₂Fe₁₄B的室温各向 关键词：     

Investigation of the pressure and temperature dependence of the intrinsic magnetic properties of YCo4Ge

The YCo₄Ge intrinsic magnetic properties; such as the saturation magnetization and the magnetocrystalline anisotropy parameters; are determined at 5, 100, 200 and 300 K from a fit of the isothermal magnetization curves measured in applied field up to 10 T. Ge for Co substitution induces a reduction of the first order anisotropy parameter as well as of the uniaxial anisotropy field. At 4 K an anisotropy field of 5.8 T is obtained, whereas a value of that is observed at room temperature. The magnetocrystalline anisotropy found for YCo₄Ge is significantly reduced upon heating from 4 to 300 K. The investigation of the magnetic properties of YCo₄Ge in both the ordered and the paramagnetic phases shows that this YCo₄Ge compound exhibits a typical itinerant ferromagnetic behavior. The effect of applied pressure on the isothermal magnetization has been investigated showing that the volume has an important influence on the magnetization of YCo₄Ge. The influence of the Ge for Co substitution on the Co-Co exchange interaction is also discussed. The results are compared and commented on in the light of earlier reports for YCo₅ and other Co containing phases.     

The role of short exchange length in the magnetization processes of L10-ordered FePt perpendicular media

A three-dimensional micromagnetic model with non-uniform grain size distribution has been built up to study the magnetization process in FePt L1₀ perpendicular media. A 3D model of a single FePt magnetic grain is also set up for comparison. The high magneto-crystalline anisotropy K_u results in a short exchange length l_ex in FePt nanograins. Therefore a magnetic grain is divided into smaller grids on the order of l_ex. The simulated perpendicular and longitudinal loops are consistent with experiments, and it is explained why the measured perpendicular H_c is relatively smaller compared with the saturation field of the longitudinal loop in the FePt perpendicular medium.     

Magnetic phase transition in (Mn0.95Ni0.05)3B4

It was found that the metallic compound (Mn_0.95Ni_0.05)₃B₄ was ferromagnetic below 195 K and antiferromagnetic between 195 and 354 K. The transition temperature from ferromagnetic to antiferromagnetic increases with increasing external magnetic field. On the other hand, the transition temperature from antiferromagnetic to paramagnetic decreases with increasing magnetic field. It is expected that the present results might be explained by the theoretical results on the coexistence of ferro- and antiferromagnetism in the itinerant electron system reported by Moriya and Usami.     

A comparative study of the magnetoelastic properties of the YFe10V2 and NdFe10V2 compounds

The magnetoelastic properties of iron-rich REFe₁₀V₂ (RE=Nd, Y) compounds were studied via magnetostriction and thermal expansion measurements in the 5–300 K range of temperature in up to 6 T external fields. Results of thermal expansion analysis show that the spontaneous magnetostriction of the compounds mostly originates from itinerant magnetization. Besides, the small volume striction appearing in the thermal expansion of the Nd compound close to 50 K suggests the existence of a basal to conical spin re-orientation transition. The volume magnetostriction isotherms of both compounds take minimum values for external field corresponding to the anisotropy field. In addition, the anisotropic and the volume magnetostriction traces of the NdFe₁₀V₂ take marked maxima under low field, with a relatively large initial magnetostrictivity, again more pronounced at the conical–axial spin re-orientation transition (T_SR=130 K). Analysis of the anisotropic magnetostriction of the Nd compound leads to the conclusion that the contribution of Nd–Fe interactions is negligible. The temperature dependence of volume magnetostriction is in good agreement with prediction of a phenomenological model based upon a fluctuating local band theory. This analysis shows that the difference between the forced volume strictions of Y and Nd compounds below and above T_SR originates from the Nd sublattice magnetization.     

Temperature and concentration dependence of magnetization,magnetocrystalline anisotropy and hyperfine parameters in Zr(Fe1−xAlx)2

Hyperfine interactions and bulk magnetic properties have been investigated in the system Zr(Fe_1?xAl_x)₂ as a function of concentration, temperature and stoichiometry. The similarity of both the concentration and the temperature dependence of the magnetization is pointed out. The influence of clusters, short range order and magnetocrystalline anisotropy on the magnetization process will be discussed. From the temperature dependence of the hyperfine field and the magnetization spin wave contributions are calculated. The applicability of the model of itinerant electron magnetism will be compared with the formation of local moments.     

Thickness dependence of magnetic domain formation in La0.6Sr0.4MnO3 epitaxial thin films studied by XMCD-PEEM

We have used photoelectron emission microscopy (PEEM) and X-ray magnetic circular dichroism (XMCD) to study the effect of thin film thickness on the magnetic domain formation in La_0.6Sr_0.4MnO₃ samples that were epitaxially grown on stepped SrTiO₃ (0 0 1) substrates. The magnetic image exhibited a stripe structure elongated along the step direction, irrespective of film thickness, suggesting that uniaxial magnetic anisotropy induced by step-and-terrace structures plays an important role in the magnetic domain formation. Additional domains evolved gradually with increasing film thickness. In these domains, the direction of magnetization differed from the step direction due to biaxial magneto-crystalline anisotropy. The evolution of additional magnetic domains with increasing film thickness implies that a competition exists between the two anisotropies in LSMO films.     

Determination of intrinsic FMR line broadening in ferromagnetic (Fe44Co56)77Hf12N11 nanocomposite films

Ferromagnetic nanocomposite (Fe₄₄Co₅₆)₇₇Hf₁₂N₁₁ films were deposited to investigate their intrinsic damping mechanisms due to scattering of itinerant electrons, which carry the magnetic moment of the ferromagnetic transition elements. The films were produced by reactive r.f. magnetron sputtering using a 6 in. Fe₃₇Co₄₆Hf₁₇ target. They were annealed at 400 °C in a static magnetic field, in order to induce in-plane uniaxial anisotropy. Subsequently, the films can be considered as uniformly magnetised. A ferromagnetic resonance frequency (FMR) of around 2.3 GHz could be attained, which was determined by measuring the real and imaginary parts of the frequency dependent permeability up to 5 GHz. The imaginary part, which represents a typical resonance curve, was utilised to obtain its full-width at half-maximum Δf_eff (FWHM) for the total damping behaviour characterisation. Thereby, it is possible to extract the intrinsic Gilbert damping parameter α_int, which in turn can be decomposed into two additional damping terms α_sf and α_os allocated to “spin-flip” and “ordinary scattering”, respectively. This result is correlated and discussed in terms of a verified theoretic model, to identify whether damping due to spin-flip scattering and/or ordinary scattering is dominant.     

NMR,magnetic susceptibility and specific heat of CrAl7

The temperature dependence of the magnetic susceptibility, Knight shift and specific heat for the compound CrAl₇ have been measured. These measurements point out that, at the temperature around T_N ≈220 K the compound CrAl₇ presents a second order phase transition from the electron itinerant antiferromagnetism state to the paramagnetic state. The NMR and magnetic susceptibility measurements are correlated and the results are discussed in terms of the electron itinerant antifer-romagnetism and rigid band models. For the temperature independent-term of the susceptibility all the contributions are given.     

Electronic structures and magnetocrystalline anisotropy energies of ordered Co1-xNix alloys: a first principles study

The electronic structures and magnetocrystalline anisotropy(MA) of ordered hexagonal close-packed(hcp) Co1-xNix alloys are studied using the full-potential linear-augmented-plane-wave(FLAPW) method with generalized gradient approximation(GGA).Great changes of magnetocrystalline anisotropy energy(MAE) are gained with different Ni compositions.Also,in-plane magnetocrystalline anisotropy is obtained for Co 15 Ni in which the Snoek’s limit is exceeded.It is found that the changes of the symmetry of the crystal field on Ni induce small variations in band structures around the Fermi level under different compositions,which plays an important role in modulating the magnetization direction,where the hybridization between Co-3d and Ni-3d orbits is of special importance in deciding the magnetocrystalline anisotropy of itinerant states.The rigid-band model is inapplicable to explain the evolution of magnetocrystalline anisotropy energy with Ni composition,and it is also inadequate to predict the magnetocrystalline anisotropy energy through the anisotropy of the orbital magnetic moment.     

CRYSTALLOGRAPHIC STRUCTURE AND INTRINSIC MAGENTIC PROPERTIES OF R2Fe14BNx

We found that the nitrogen atoms can enter into the R₂Fe₁₄B structure by a proper heat treatment in nitrogen atmosphere. The crystallographic structure and magnetic properties of R₂Fe₁₄BN_x, R =Nd and Y, have been investigated by using X-ray and neutron diffraction techniques as well as magnetic measurements. The neutron diffrac-tion data show that the nitrogen atoms occupy the 4f interstices. The interstitial nitrogen atoms were found to have an effect of enhancing Curie temerature, whereas, decreasing saturation magnetization and magneto-crystalline anisotropy. The rela-tionship of the crystal structure and the intrinsic magnetic properties of this crystal is discussed.