Effect of hydrostatic pressure on the magnetic and lattice properties of the ferromagnet La(Fe0.86Si0.14)13

The temperature dependence of the lattice constant of the ferromagnet La(Fe_0.86Si_0.14)₁₃ has been measured at different pressures and temperatures. The numerical value of the bulk modulus at room temperature has been determined. The measurements of the temperature dependence of the lattice constant of the ferromagnet La(Fe_0.86Si_0.14)₁₃ at zero pressure and at 11.5 kbar have demonstrated that, at zero pressure, the lattice constant sharply decreases in the range from 160 to 210 K, whereas at a pressure of 11.5 kbar, the lattice constant decreases in the range from 110 to 180 K. This indicates that the Curie temperature T _C changes from 210 to ～170 K under pressure. The experimental results have been analyzed using the equations of states for the magnetic and elastic subsystems of the ferromagnet.     

NMR on 55Mn in the ferromagnetic Ni-substituted manganite La0.6Pb0.4Mn0.86Ni0.14O3

NMR on ⁵⁵Mn in the single-crystal manganite La_0.6Pb_0.4Mn_0.86Ni_0.14O₃ (T _C =242 K), which exhibits metallic conductivity below T _C , is investigated in the temperature range 61–215 K. At low temperatures, together with a line corresponding to the averaged hyperfine field at the ⁵⁵Mn nuclei (the averaging is due to the motion of electronic holes along Mn sites), the NMR spectrum also contains two lines corresponding to localized states Mn⁴⁺ and Mn³⁺. In the temperature range 100–200 K it is found that the complicated NMR spectrum is transformed into a single line on account of a delocalization of the holes in the e _g orbitals of manganese. A comparison of the NMR data with the temperature dependence of the resistivity suggsets that a wide distribution of charge-carrier mobilities exists in the crystal. Pis’ma Zh. éksp. Teor. Fiz. 70, No. 8, 522–527 (25 October 1999)     

Magnetic behaviour of the cubic La(Fe,Al)13 compounds

The magnetic properties of the cubic NaZn₁₃ type pseudobinary compounds LaFe_XAl_13–x were studied in the temperature range T=4.2–300 K by means of⁵⁷Fe-Mössbauer spectroscopy, magnetization and zero-field susceptibility measurements. The compounds LaFe_xAl_13–x show a rather peculiar concentration dependence of the type of magnetic ordering as well as of the ordering temperature.     

Magnetic properties and magnetocaloric effects in NaZn13-type La（Fe, Al）13-based compounds

In this article,our recent progress concerning the effects of atomic substitution,magnetic field,and temperature on the magnetic and magnetocaloric properties of the LaFe13-xAlx compounds are reviewed.With an increase of the aluminum content,the compounds exhibit successively an antiferromagnetic(AFM) state,a ferromagnetic(FM) state,and a mictomagnetic state.Furthermore,the AFM coupling of LaFe 13-xAlx can be converted to an FM one by substituting Si for Al,Co for Fe,and magnetic rare-earth R for La,or introducing interstitial C or H atoms.However,low doping levels lead to FM clusters embedded in an AFM matrix,and the resultant compounds can undergo,under appropriate applied fields,first an AFM-FM and then an FM-AFM phase transition while heated,with significant magnetic relaxation in the vicinity of the transition temperature.The Curie temperature of LaFe13-xAlx can be shifted to room temperature by choosing appropriate contents of Co,C,or H,and a strong magnetocaloric effect can be obtained around the transition temperature.For example,for the LaFe 11.5Al1.5C0.2H1.0 compound,the maximal entropy change reaches 13.8 J·kg-1 ·K-1 for a field change of 0-5 T,occurring around room temperature.It is 42% higher than that of Gd,and therefore,this compound is a promising room-temperature magnetic refrigerant.     

Magnetic phase diagram of La(Fe0.873Co0.007Al0.12)13 cluster intermetallic compound

The magnetic properties of the La(Fe_0.873Co_0.007Al_0.12)₁₃ intermetallic compound have been studied. The compound is a cluster antiferromagnet showing the metamagnetic transition. The magnetic phase diagram of the compound has been constructed. The temperature dependence of the inverse paramagnetic susceptibility of La(Fe_0.873Co_0.007Al_0.12)₁₃ obeys the Curie–Weiss law. The large positive paramagnetic Curie point indicates the presence of predominantly ferromagnetic exchange interactions. The Neel temperature can be considered as the temperature of the ferromagnetic ordering of the Fe magnetic moments in clusters coupled antiferromagnetically.     

Magnetism and superconductivity in Eu0.2Sr0.8(Fe0.86Co0.14)2As2 probed by 75As NMR

We report bulk superconductivity (SC) in Eu(0.2)Sr(0.8)(Fe(0.86)Co(0.14))(2)As(2) single crystals by means of electrical resistivity, magnetic susceptibility and specific heat measurements with T(c) is approximately equal to 20 K and an antiferromagnetic (AFM) ordering of Eu(2+) moments at T(N) is approximately equal to 2.0 K in zero field. (75)As NMR experiments have been performed in the two external field directions (H is parallel to ab) and (H is parallel to c). (75)As-NMR spectra are analysed in terms of first-order quadrupolar interaction. Spin-lattice relaxation rates (1/T(1)) follow a T(3) law in the temperature range 4.2-15 K. There is no signature of a Hebel-Slichter coherence peak just below the SC transition, indicating a non-s-wave or s(±) type of superconductivity. In the temperature range 160-18 K 1/T(1)T follows the C/(T+θ) law reflecting 2D AFM spin fluctuations.     

Machine learning technique for prediction of magnetocaloric effect in La(Fe,Si/Al)_(13)-based materials

Data-mining techniques using machine learning are powerful and efficient for materials design, possessing great potential for discovering new materials with good characteristics. Here, this technique has been used on composition design for La(Fe,Si/Al)_(13)-based materials, which are regarded as one of the most promising magnetic refrigerants in practice. Three prediction models are built by using a machine learning algorithm called gradient boosting regression tree(GBRT) to essentially find the correlation between the Curie temperature(T_C), maximum value of magnetic entropy change((?S_M)_(max)),and chemical composition, all of which yield high accuracy in the prediction of T_C and(?SM)_(max). The performance metric coefficient scores of determination(R~2) for the three models are 0.96, 0.87, and 0.91. These results suggest that all of the models are well-developed predictive models on the challenging issue of generalization ability for untrained data, which can not only provide us with suggestions for real experiments but also help us gain physical insights to find proper composition for further magnetic refrigeration applications.     

Coherent oscillations of holes in GaAs0.86P0.14/Al0.7Ga0.3As surface quantum well

We show that in a GaAs_0.86P_0.14/Al_0.7Ga_0.3As near-surface quantum well, there is coherent oscillation of holes observed in time-resolved reflectivity signal when the top barrier of the quantum well is sufficiently thin. The quantum well states interact with the surface states under the influence of the surface electric field. The time period of the observed oscillation is 120±10 fs.     

The formation and stability of quasicrystal in Al80Mn14Si6 under high static pressure

Abstract

The method of quenching in fusing state under high static pressure (MQFSHP) was applied for the first time to prepare the quasicrystal icosahedral phase of Al₈₀Mn₁₄Si₆ alloy. The pressure was from 2.8GPa to 3.1GPa and the cooling rate during quenching was of about 100°C/s. Some sharp electron diffraction spots showing an arrangement with a five-fold symmetry axis and noncrystalline ring have been observed in electron diffraction experiment.

The crystallization temperature of I phase obtained from high pressure(HP) is close to that of rapid cooling ribbon, but the cooling rate of the sample obtained is lower than that of rapid cooling ribbon.     

Asymmetric first‐order transition and interlocked particle state in magnetocaloric La(Fe,Si)13

In‐situ synchrotron XRD measurements of the magnetocaloric material LaFe_11.8Si_1.2 are used to understand virgin effects and asymmetry of the underlying first order magnetovolume transition. A remarkable change of the transition kinetics occurs after the first cycle, which we attribute to the formation of cracks originating from the volume change. Tomographic imaging revealed that the bulk material disintegrates via an interlocked state where fragments are loosely connected. Though cracks have opened between the fragments, the transition is sharp, which we attribute to magnetostatic interactions. In the cycled sample we find a strong asymmetry between the transition interval upon heating and cooling, which we explain by isostatic pressure acting on parts of the sample during the cooling transition. (© 2015 WILEY‐VCH Verlag GmbH &Co. KGaA, Weinheim)     

The ferromagnetic monolayer Fe(110) on W(110)

Ferromagnetic order in the pseudomorphic monolayer Fe(110) on W(110) was analyzed experimentally using Conversion Electron Mössbauer Spectroscopy (CEMS) and Torsion Oscillation Magnetometry (TOM). The monolayer is thermodynamically stable, crystallizes to large monolayer patches at elevated temperatures and therefore forms an excellent approximation to the ideal monolayer structure. It is ferromagnetic below a Curie-temperatureT _c,mono, which is given by (282±3) K for the Ag-coated layer, (290±10) K for coating by Cu, Ag or Au and ≈210 K for the free monolayer. For the Ag-coated monolayer, ground state hyperfine fieldB _hf (0)=(11.9±0.3) T and magnetic moment per atom μ=2.53 μ_B could be determined, in fair agreement with theoretical predictions. Unusual properties of the phase transition are detected by the combination of both experimental techniques. Strong magnetic anisotropies, which are essential for ferromagnetic order, are determined by CEMS.     

Multiple metamagnetic transitions in the magnetic refrigerant La(Fe,Si)13Hx

The effect of hydrostatic pressure on thermally and field-induced first-order magnetic phase transitions is studied in the La(Fe,Si)_(13)-type compounds. A peculiar series of consecutive field-induced transitions is realized using a distinct combination of hydrostatic pressure and negative pressure created by the interstitial insertion of hydrogen. The pressure-induced discontinuous magnetization jumps result in an enhanced cooling power, thus opening up the possibility to exploit in full the magnetocaloric potential of this compound class.     

钍基碳化物ThC的高压结构稳定性研究

钍基碳化物ThC是重要的核材料,基于第一性原理计算,我们研究了ThC的结构稳定性及相变.声子色散曲线表明基态结构的晶格能够稳定到42 GPa附近,当压力继续升高时虚频的出现表明了动力学的不稳定.经比较基态Fm-3m及高压相Pnma结构的自由能,发现零温下,相变压力为22.4 GPa,符合声子色散曲线的结果,同时预测了两种结构的相变边界.     

高温高压下钼的结构稳定性研究

以钼为代表的一系列过渡金属,在高温高压的相变及结构稳定性研究是实验和理论研究的热点.钼在常温常压下是bcc结构,但是在高温高压下可能的相结构一直未能确定.本文首先预测了几种高压下的结构,并计算了其自由能及力学性质.针对可能的hcp结构,我们通过新近发展的自洽晶格动力学方法,充分考虑声子间相互作用,成功获得了hcp结构高温高压声子色散曲线,结果表明hcp相在热力学及动力学上都是能够稳定存在的结构,是一种可能的高压相.     

极端条件下锆的动力学稳定性研究

过渡金属Zr具有优良的物理、化学及力学性能, 具有广泛的应用价值. 主要通过新近发展的自洽晶格动力学方法, 充分考虑声子间的相互作用, 成功获得了β-Zr的高温高压声子色散曲线, 预测了β-Zr在相图中能够稳定存在的区域, 进一步比较α-Zr, ω-Zr和β-Zr的自由能, 获得了α-β 及ω-β 相变的相边界, 构建了Zr的参考相图. 同时, 也获得了β-Zr的高温状态方程及热膨胀系数, 能够为构建Zr的全区物态方程提供有益的参考.     

Structural stability of tin clathrates under high pressure

High pressure Raman scattering experiments have been performed for Rb₈Sn₄₄□₂ in order to investigate the pressure induced phase transition. At pressures of 6.0 and 7.5 GPa, Raman spectrum was drastically changed, indicating the phase transitions. The irreversibility of the spectral change and the disappearance of Raman peak observed at 7.5 GPa strongly suggest the occurrence of irreversible amorphization.