Li0.5-0.5xZnxFe2.5-0.5xO4纳米纤维的电纺制备及其结构和磁性能

以聚乙烯吡咯烷酮、硝酸锂、硝酸锌和硝酸铁为主要原料,通过静电纺丝技术结合后期的热处理制备了直径在50～100 nm的单相Li0.5-0.5xZnxFe2.5-0.5xO4（x=0.0,0.2,0.3,0.4,0.5,0.8）纳米纤维.利用热重-差热分析、X射线衍射、场发射扫描电子显微镜、透射电子显微镜和振动样品磁强计研...     

Effects of unsymmetrical geometric confinements on depletion interactions in colloidal suspensions

The depletion interactions between two large-spheres immersed in a fluid of small spheres under unsymmetrical geometrical confinement are studied through the acceptance ratio method. The numerical results show that no matter whether the volume fraction is large or small, both the depletion potential and depletion force are affected by the presence of the two plates; the closer the two large spheres are to the plate, the larger the effects of the unsymmetrical confinements.     

Effect of Geometrical Confinement on Depletion Interactions in Colloidal Suspensions

The depletion effect between two big hard spheres in a sea of small spheres under a geometrical confinement is studied by Monte Carlo simulations. The numerical results show that both the depletion potential and depletion force are sensitive to the geometrical confinements.     

约束条件下胶球间排空力的研究

用MonteCarlo方法对处于两平行硬板约束下三个浓度的大小胶球系统进行了模拟,通过对大胶球表面小胶球密度的统计,由密度积分公式获得了大胶球所受的排空力.研究结果显示,因为平行硬板的存在或当改变两平行硬板的距离时,同浓度下,排空力在硬板距离小的时候最明显;三个浓度中,浓度高的,排空力受硬板距离影响最大;有硬板约束比无该约束的时候,排空力效果更显著.     

Grand Canonical Ensemble Monte Carlo Simulation of Depletion Interactions in Colloidal Suspensions

Depletion interactions in colloidal suspensions confined between two parallel plates are investigated by using acceptance ratio method with grand canonical ensemble Monte Carlo simulation. The numerical results show that both the depletion potential and depletion force are affected by the confinement from the two parallel plates. Furthermore, it is found that in the grand canonical ensemble Monte Carlo simulation, the depletion interactions are strongly affected by the generalized chemical potential.     

A Monte Carlo Study of Influences on Depletion Force from Another Large Sphere in Colloidal Suspensions

According to the acceptance ratio method, the influences on the depletion interactions between a large sphere and a plate from another closely placed large sphere are studied by Monte Carlo simulation. The numerical results show that both the depletion potential and depletion force are affected by the presence of the closely placed large sphere; the closer the large sphere are placed to them, the larger the influence will be. Furthermore, the influences on the depletion interactions from another large sphere are more sensitive to the angle than to the distance.     

锑烯表面碱金属原子吸附和扩散行为研究

锑烯是一种新兴的具有多种新奇特性的二维材料.本文基于密度泛函理论的第一性原理方法,主要研究了Li、Na、K原子在锑烯表面的吸附和扩散行为.结果显示,Li、Na、K原子在锑烯表面吸附时,具有较大的吸附能,分别为-2.36 eV,-1.84 eV和-1.60 eV.通过引入垂直于衬底指向吸附原子的外电场,发现它们的吸附能和转移电荷都随着外加电场的增加而增加,其中对K原子的吸附能和转移电荷影响最显著.采用Climbing Image-NudgedElastic Band (CI-NEB)的方法研究得出Li、Na和K在锑烯表面的扩散行为都具有较小的扩散势垒,其中Li为0.09eV,Na为0.08 eV,而K仅有0.04 eV,这有利于碱金属原子在锑烯表面的扩散.研究结果为进一步了解锑烯的性质和应用推广提供了基础理论支持.