ZnO1-xCx稀磁半导体的磁特性的第一性原理和蒙特卡罗研究

利用第一性原理计算得到C掺杂ZnO的电子结构,发现系统具有半金属的电子结构.从态密度的分析可以看到Zn-3d和C-2p电子具有强烈的杂化作用,这是体系具有相对稳定铁磁基态的原因.利用第一性原理得到的磁性耦合强度并结合蒙特卡罗模拟得到了C掺杂浓度为555%,833%,125%的ZnO_1-xC_x分别具有210 K,260 K,690 K的居里温度.同时,详细地分析了C掺杂引起的电子转移和C,Zn,O的s,p和d电子的自旋向上和自旋向下电子数的变化.通过比较研究,发现ZnO_1-xC_x的局域磁矩主要来源于Zn-3d 电子和C-2p 电子之间的相互作用,而局域磁矩耦合倾向于RKKY耦合. 关键词： 1-xC_x')" href="#">ZnO_1-xC_x 磁性 第一性原理 蒙特卡罗模拟     

Effect of C doping on the structural and electronic properties of LiFePO4: A first-principles investigation

Using first-principles calculations within the generalized gradient approximation （GGA） ＋U framework, we inves- tigate the effect of C doping on the structural and electronic properties of LiFePO4. The calculated formation energies indicate that C doped at O sites is energetically favoured, and that C dopants prefer to occupy 03 sites. The band gap of the C doped material is much narrow than that of the undoped one, indicating better electro- conductive properties. To maintain charge balance, the valence of the Fe nearest to C appears as Fe3＋, and it will be helpful to the hopping of electrons.     

三方晶系的非线性磁光克尔谱及其表面磁化强度取向的效应

本文计算了三方结构不同表面和不同磁化强度取向下的χ⁽²⁾、SHG、MSHG及非线性克尔旋转角Φ_k,a⁽²⁾.结果表明,SHG和Φ_k,a⁽²⁾值非常灵敏地依赖于薄膜的表面及磁化强度的取向;三方结构的SHG、Φ_k,a⁽²⁾与fcc、bcc和hcp结构的相比有很大的差异,这表明结构对非线性磁光效应有重要的影响;当M//X、Y轴时,MSHG信号很明显,这表明可通过A值的测量来研究磁性薄膜表面的磁畴结构以及取向.     

基于ARM11的无创心血管健康评估系统设计

为了使用低成本、无创伤且易操作的方法评估人体心血管的健康状况,设计一个基于ARM11(S3C6410)的无创心血管健康评估系统,该系统由无创心血管参数检测探头、嵌入式人机交互平台和内嵌的健康评估模型三个部分组成。基于能量代谢守恒法、指端容积脉搏波检测等研制出无创检测探头,用于测量血压、血流速度和血糖等人体参数,采用蓝牙4.0设备将数据传输至嵌入式人机交互平台,数据经改进后的国人缺血性心血管病(ICVD)10年发病危险评估模型得出健康评估结果。实验结果表明该方法所得评估结果和微创真值经原始ICVD评估模型所得评估结果的Pearson相关系数为0.91(Spearman相关系数为0.891),说明该方法是可行的。     

Monte Carlo Simulation of Magnetization Behaviour of Co Nanowires

Based on the Monte Carlo method, we simulate the magnetization curves with various magnetic field orientations for various single Co nanowires at room temperature. The simulated switching field as a function of angle between the field and the wire axis is consistent well with the experimental data. Correspondingly, the coercivity as a function of angle θ is presented, which together with the switching field plays an important role on explaining the magnetic reversal mechanism. It is found that the angular dependence of coercivity depends on the diameter of nanowires, and the coercivity and switching field versus θ deviate markedly from the prediction from the classical uniform rotation mode in the chain-of-sphere model. Furthermore, the magnetic reversal configurations display that magnetization reversal in the wires with small diameters is a nucleation-propagation process, and it is similar to the curling spread process in the larger wires.     

Ni005A自动安平水准仪测微成像系统故障分析与调整

分析了Ni005A自动安平水准仪测微成像系统的结构原理,介绍了此类仪器的测微光学系统常见故障判断与调整方法,提出了应用一小凸透镜和一块毛面白纸条对测微成像系统进行逐段检查的快速检修方法.