退火对高Co含量Ti1-zCoxO2磁性半导体的影响

利用磁控溅射仪制备了高Co含量的Ti1-xCocO2磁性半导体样品,并对样品分别在200℃,300℃和400℃进行退火研究.使用透射电子显微镜(TEM)对退火前后样品的结构进行表征,并用X射线光电子能谱(XPS)对退火前后样品中Co元素的化学状态进行鉴定.结果表明高Co含量的Ti1-xCoxO2磁性半导体处于一种亚稳状态,300℃以上的温度便使其结构与成分发生巨大变化.利用超导量子干涉磁强计(SQUID)测量退火前后样品的磁特性.结果表明样品的磁性有了明显的变化,这源于磁性产生的不同机理.     

非闭环结构下有机磁性材料中的自旋密度波性质

研究了有机磁性聚合物ploy-BIPO链的封闭和非封闭结构对体系自旋密度（SDW)的影响.在开链情况下,自旋耦合与电子-电子相互作用对主链SDW的形成存在竞争,自旋耦合有利于SDW的形成;而电子-电子相互作用对SDW起到抑制作用.闭环下,没有得到这些结论. 关键词：     

Electrical property effect of oxygen vacancies in the heterojunction of LaGaO_3/SrTiO_3

Density functional theory within the local density approximation is used to investigate the effect of the oxygen vacancy on the LaGaO_3/SrTiO_3(001) heterojunction. It is found that the energy favorable configuration is the oxygen vacancy located at the 3~(rd) layer of the STO substrate, and the antiferrodistortive distortion is induced by the oxygen vacancy introduced on the SrTiO_3 side. Compared with the heterojunction without introducing oxygen vacancy, the heterojunction with introducing the oxygen vacancy does not change the origin of the two-dimensional electron gas(2DEG), that is, the 2DEG still originates from the d_(xy) electrons, which are split from the t~(2g) states of Ti atom at interface; however the oxygen vacancy is not beneficial to the confinement of the 2DEG. The extra electrons caused by the oxygen vacancy dominantly occupy the 3d_(x~2-y~2) orbitals of the Ti atom nearest to the oxygen vacancy, thus the density of carrier is enhanced by one order of magnitude due to the introduction of oxygen vacancy compared with the density of the ideal structure heterojunction.     

Novel Fe_3O_4@SiO_2@Ag@Ni trepang-like nanocomposites:High-efficiency and magnetic recyclable catalysts for organic dye degradation

A facile step-by-step approach is developed for synthesizing the high-efficiency and magnetic recyclable Fe_3O_4@SiO_2@Ag@Ni trepang-like nanocomposites.This method involves coating Fe_2O_3 nanorods with a uniform silica layer,reduction in 10%H_2/Ar atmosphere to transform the Fe_2O_3 into magnetic Fe_3O_4,and finally depositing Ag@Ni core-shell nanoparticles on the L-lysine modified surface of Fe_3O_4@SiO_2 nanorods.The fabricated nanocomposites are further characterized by x-ray diffraction,transmission electron microscopy,scanning electron microscope,Fourier transform infrared spectroscopy,and inductively coupled plasma mass spectroscopy.The Fe_3O_4@SiO_2@Ag@Ni trepang-like nanocomposites exhibit remarkably higher catalytic efficiency than monometallic Fe_3O_4@SiO_2@Ag nanocomposites toward the degradation of Rhodamine B(RhB) at room temperature,and maintain superior catalytic activity even after six cycles.In addition,these samples could be easily separated from the catalytic system by an external magnet and reused,which shows great potential applications in treating waste water.     

Structural and physical properties of BiFeO3 thin films epitaxially grown on SrTiO3（001） and polar（111） surfaces

The influence of surface polarity on the structural properties of BiFeO3 （BFO） thin films is investigated. BFO thin films are epitaxially grown on SrTiO3 （STO） （100） and polar （111） surfaces by oxygen plasma-assisted molecular beam epitaxy. It is shown that the crystal structure, surface morphology, and defect states of BFO films grown on STO substrates with nonpolar （001） or polar （111） surfaces perform very differently. BFO/STO （001）is a fully strained tetragonal phase with orientation relationship （001）[100]BFOII（001）[100]STO, while BFO/STO （111） is a rhombohedral phase. BFO/STO （111） has rougher surface morphology and less defect states, which results in reduced leakage current and lower dielectric loss. Moreover, BFO films on both STO （001） and STO （111） are direct band oxides with similar band gaps of 2.65 eV and 2.67 eV, respectively.     

Universal spin-dependent variable range hopping in wide-band-gap oxide ferromagnetic semiconductors

This paper proposes a universal spin-dependent variable range hopping theoretical model to describe various experimental transport phenomena observed in wide-band-gap oxide ferromagnetic semiconductors with high transition metal concentration. The contributions of the `hard gap' energy, Coulomb interaction, correlation energy, and exchange interaction to the electrical transport are considered in the universal variable range hopping theoretical model. By fitting the temperature and magnetic field dependence of the experimental sheet resistance to the theoretical model, the spin polarization ratio of electrical carriers near the Fermi level and interactions between electrical carriers can be obtained.     

LJ团簇和H2O团簇的局域优化计算

将传统分子动力学方法中时间积分步长定义成粒子的最大加速度、最大速度和变化的最大允许空间步长的函数,并给出了空间步长的确定方法.作为对这个算法有效性的检验,计算了较小Lennard-Jones团簇和H₂O团簇的稳定结构,发现了新的(H₂O)₁₃的最小能结构.     

Polaronic Tunnelling in Organic Triblock Copolymers

Polaron tunnelling is studied in xPA/nPPP/xPA (PA for polyacetylene and PPP poly (p-phenylene)) triblock copolymer, which has a well-barrier-well structure. An extended tight-binding Hamiltonian including external electric field is adopted. Without electric field, the injected electrons would not extend over the whole copolymer chain but instead be confined in the segments of PA. This is different from the behaviour of the traditional semiconductors. It is found that the polaron can transfer to the potential barrier-PPP segment when the applied electric field reaches a certain value. The critical polaron tunnelling electric fields depend upon the lengths of PPP segments.     

Magnetic and Transport Properties of ZnO／Co Nanomultilayers

[ZnO(0.5 nm)/Co(0.6 nm)]60 multilayers were fabricated by magnetron sputtering. The magnetic, transport and optical properties were studied. The ferromagnetic state at low temperature was demonstrated. Most of the grains in the samples will be unblocked when temperature is below 50K. The measured magneto-resistance at 4.8K is higher than 30%. This value is larger than any other reported data. The transport mechanism may come down to a combination of tunnelling conduction with the second-order hopping. Some small peaks on transmittance curves were found, the matter is still open.     

电子关联和孤子

聚乙炔中的电子关联和孤子可用相关基函数方法(CBF)来研究,通过考虑完全的电子-电子相互作用,得到含有单个电荷的奇数原子链的稳定位形为孤子的结论,随着电子-电子互作用强度U和互作用程α/β的增加,孤子定域性加强,产生能降低,因此,即使计入电子-电子相互作用,孤子仍然是导电聚合物中的主要载流子。 关键词：