Influence of spin–orbit interaction,Zeeman effect and light polarisation on the electronic and optical properties of pseudo-elliptic quantum rings under magnetic field

ABSTRACT

We theoretically investigated the influences of the magnetic field and light polarisation on the electronic and optical properties of a GaAs/GaAlAs pseudo-elliptic quantum ring, modelled by an outer ellipsis and an inner circle, in the presence of the Rashba and Dresselhaus spin–orbit interactions and Zeeman effect. We show that Aharonov-Bohm oscillations of the energy spectrum are not affected by the presence of the Zeeman effect alone but, in the presence of Rashba and Dresselhaus spin–orbit couplings, the periodicity of certain levels becomes hardly definite. The Zeeman effect generally enhances/diminishes the separation levels produced by Rashba/Dresselhaus interactions (SOI) and when both types of SOI are considered, the effect depends on their relative strength. The magnetic field can trigger spin-flip for each type of spin–orbit interaction and Zeeman effect or their combination through anticrossings in the energy spectra. Our results reveal that the absorption spectra are very sensitive to the magnetic field and light polarisation. For all polarisations considered, the magnetic field increment leads to the redshift or blueshift of some particular peaks (an effect of this ring geometry) and a better separation of the peaks. The x-polarised light determines spectra with many small, but separated peaks while the circular polarised light leads to spectra with large peaks of high amplitude.     

Exsolution of Nickel Nanoparticles from Mixed-Valence Metal Oxides: A Quantitative Evaluation by Magnetic Measurements

A fast and accurate experimental method is demonstrated to assess the fraction of exsolved metallic nanoparticles using magnetic measurements. As a benchmark, nanometric metallic nickel exsolved from (La_1−xSr_x)(Cr_1−yNi_y)O_3−δ is used for its high relevance as a solid oxide fuel cell component. The method is based on the difference in the magnetic response of the exsolved metallic nickel (ferromagnetic) and Sr-doped lanthanum chromite ceramic matrix (paramagnetic). The exsolved nickel results in coherent nanoparticles pinned on the surface of the Sr-doped lanthanum chromite ceramic matrix, as evidenced by electron microscopy analyses. The results obtained indicate the procedure as a fast and sensitive method to study the exsolution of ferromagnetic nanoparticles.     

Change in motor cortex activation for muscle release by motor learning

For central nervous system disorders'' rehabilitation, it is important to accurately understand motor control and implement an appropriate motor learning process to induce neuroplastic changes. The neurophysiological studies have revealed that neural control mechanisms are crucial during both the onset of muscular activities and muscle release after contraction. When performing various movements during daily activities, muscle relaxation control enables precise force output and timing control. Moreover, surround inhibition is a functional mechanism in the motor system. Surround inhibition of the motor system may be involved in the selective execution of desired movements. This review demonstrates cortical excitability resulting from motor learning, movement control mechanisms including muscle relaxation and the suppression of nontarget muscle groups, and the voluntary drive''s importance that is required for movement.     

Palladium on magnetic Irish moss: A new nano‐biocatalyst for suzuki type cross‐coupling reactions

A novel heterogeneous magnetic palladium nano‐biocatalyst was designed by utilizing Irish moss, a family of sulfated polysaccharides extracted from algae, as a natural biopolymer. This magnetic Irish moss decorated with palladium (Pd–Fe₃O₄@IM) to form a biomagnetic catalytic system was synthesized and well characterized by FT–IR analysis, X‐ray powder diffraction, field emission scanning electron microscopy, energy‐dispersive X‐ray spectroscopy, atomic absorption spectroscopy and transmission electron microscopy. The catalyst was stable to air and moisture and displayed high catalytic activity in ligand‐free Suzuki–Miyaura cross‐coupling reactions conducted under green chemistry reaction conditions. The aromatic ketones are produced by the cross‐coupling reaction between acid chlorides and aryl boronic acid derivatives in high yields.     

Probing the Local Magnetic Structure of the [FeIII(Tp)(CN)3]− Building Block Via Solid-State NMR Spectroscopy,Polarized Neutron Diffraction,and First-Principle Calculations

The local magnetic structure in the [Fe^III(Tp)(CN)₃]⁻ building block was investigated by combining paramagnetic Nuclear Magnetic Resonance (pNMR) spectroscopy and polarized neutron diffraction (PND) with first-principle calculations. The use of the pNMR and PND experimental techniques revealed the extension of spin-density from the metal to the ligands, as well as the different spin mechanisms that take place in the cyanido ligands: Spin-polarization on the carbon atoms and spin-delocalization on the nitrogen atoms. The results of our combined density functional theory (DFT) and multireference calculations were found in good agreement with the PND results and the experimental NMR chemical shifts. Moreover, the ab-initio calculations allowed us to connect the experimental spin-density map characterized by PND and the suggested distribution of the spin-density on the ligands observed by NMR spectroscopy. Interestingly, significant differences were observed between the pseudo-contact contributions of the chemical shifts obtained by theoretical calculations and the values derived from NMR spectroscopy using a simple point-dipole model. These discrepancies underline the limitation of the point-dipole model and the need for more elaborate approaches to break down the experimental pNMR chemical shifts into contact and pseudo-contact contributions.     

A New Class of Lanthanide Complexes with Three Ligand Centered Radicals: NMR Evaluation of Ligand Field Energy Splitting and Magnetic Coupling

Combination of three radical anionic Ph-BIAN ligands (Ph-BIAN=bis-(phenylimino)-acenaphthenequinone) with lanthanoid ions leads to a series of homoleptic, six-coordinate complexes of the type Ln(Ph-BIAN)₃. Magnetic coupling data were measured by paramagnetic solution NMR spectroscopy. Combining ¹H NMR with ²H NMR of partially deuterated compounds allowed a detailed study of the magnetic susceptibility anisotropies over a large temperature range. The observed chemical shifts were separated into ligand- and metal-centered contributions by comparison with the Y analogue (diamagnetic at the metal). The metal-centered contributions of the complexes with the paramagnetic ions could then be separated into pseudocontact and Fermi contact shifts. The latter is large within the Ph-BIAN scaffold, which shows that magnetic coupling is significant between the lanthanide ion and the radical ligand. Pseudocontact shifts were further correlated to structural data obtained from X-ray diffraction experiments. Ligand-field parameters were determined by fitting the temperature dependence of the observed magnetic susceptibility anisotropies. The electronic structure determined by this approach shows, that the Er and Tm analogues are candidates for single molecule magnets (SMM). These results demonstrate the possibilities for the application of NMR spectroscopy in investigations of paramagnetic systems in general and single molecule magnets in particular.     

Nano-sized local magnetic field induced by circular motion of ions and molecules in a nanotorus under gigahertz rotating electric fields

Recently, we reported molecular dynamics simulations of stable cyclotron motions of ions and water molecules in a carbon nanotorus, induced by different rotating electric fields (EFs). This study is devoted to the calculation and characterisation of the magnetic field (MF) induced by these cyclotron motions. Results show that carbon nanotorus containing ions or water molecules acts as an EF-to-MF transducer. Components of the instantaneous induced MF show large-scale oscillations superimposed by strong fluctuations arising respectively from overall circular motion and random collisions of moving species. Analysis of the space-dependencies of the induced MF components shows that the induced MF is maximum at the centre of the nanotorus. The MF induced by cyclotron motion of ions follows the orders B(Ca²⁺)?>?B(Na⁺)?≈?B(K⁺) at E?=?1.0?V/nm and B(E?=?1.0?V/nm)?>?B(E?=?0.5?V/nm)?>?B(E?=?0.1?V/nm). The time-averaged induced MF of the cyclotron motion of 81 water molecules is almost 10² times stronger than that of ions. The induced MF strength is decreased with increasing distance from nanotorus and decays effectively at about 17.3–18.1 and 15.9–18.2?nm along the z-axis of the nanotorus for ions and water molecules, respectively. The magnitude of the MF induced by cyclotron motions of water molecules and ions, respectively, decreases and increases in the nanotorus with freed carbon atoms.     

新郑西亚斯东周玉器材料属性与加工工艺的科技分析

中国玉文化源远流长，治玉工艺经过各个时代的不断发展和完善，在一定程度上能反映古代社会生产力发展水平及文化、贸易、技术交流等信息。利用能量色散型X射线荧光光谱（EDXRF）、激光拉曼光谱（LRS）、超景深光学显微系统（OM）等分析技术，结合硅胶覆膜微痕复制技术，对河南省新郑西亚斯东周墓地出土的一批玉器进行科技分析。首先利用化学成分和物相结构分析技术确定了玉器材质的矿物属性，其次利用显微分析技术表征了玉器表面及穿孔内部和印模的加工痕迹，特别是阴刻纹饰和穿孔微痕特征，最后探讨了玉器样品的材料属性和加工工艺两者之间的联系。化学成分和物相结构分析结果表明，所分析的西亚斯东周玉器材质丰富，主要矿物组成有滑石、透闪石、水晶、云母等。玉器表面纹饰微痕特征分析表明，所分析玉器阴刻工艺采用了两种加工工具，分别是砣具和手持硬质工具。穿孔微痕分析特征表明，钻孔包括单面钻孔和双面/多面钻孔两种方式，钻孔工艺则有实心钻、管钻等。部分玉器钻孔形状和内部微痕特征表明，尽管均采用了实心钻工艺，但所采用的实心钻头在形状上存在差异，同时，也存在是否配合解玉砂进行钻孔的差异。不同材料属性的玉器采用了不同的加工工艺。滑石质玉器，莫氏硬度1，器型主要为玉片饰，其表面阴刻纹饰主要采用手持硬质工具进行刻画，钻孔主要采用了双面钻孔方式，并使用了实心钻头未添加解玉砂进行加工，钻头形状可能为圆锥状；云母质玉器，莫氏硬度2~3，器型主要为玉玦片饰，纹饰采用了砣具添加解玉砂的加工工艺，钻孔方式为单面钻孔，采用了管钻工艺。透闪石型玉器，莫氏硬度5~6，器型主要为玉片饰，表面纹饰采用砣具配合解玉砂砣刻，以双面钻孔的方式为主，钻孔工艺为实心钻头配合解玉砂工艺，钻头形状与滑石类样品一致，为圆锥状。水晶质玉器，莫氏硬度7，均为珠饰，表面无纹饰，钻孔方式为双面/多面钻孔，钻孔工艺为实心钻配合解玉砂工艺，且钻头可能为圆柱形。研究结果表明，玉器表面纹饰所采用的阴刻工艺和钻孔工艺，与玉器本身的材料属性、器型等存在密切关系。     

Anchored Ni-dimethylglyoxime complex on Fe3O4@SiO2 core/shell nanoparticles for the clean catalytical synthesis of dicoumarols

Ni-Dimethylglyoxime complex immobilized on functionalized Fe₃O₄ was synthesized by a post-grafting way and utilized as a novel, thermally stable, recoverable, and efficient for green synthesis of dicoumarols through reaction of 4-hydroxycoumarin with various aldehydes in excellent yields and higher rate. Fe₃O₄@SiO₂-silylcyclopropyl-dimethylglyoxime-Ni superparamagnetic nanoparticles (MNP_s) were investigated by Fourier transform infrared spectroscopy, scanning electron microscopy, energy dispersive X-ray spectroscopy, X-ray diffraction, vibrating sample magnetometer, and Brunauer–Emmett–Teller technique. This nanocatalyst could be conveniently recovered via the use of an external magnetic field and reused for subsequent reactions for at least 7 times without any remarkable change and decrease in catalytic activity.