Effect of strain on charge density wave order in α-U

The effect of strain on charge density wave (CDW) order in $\alpha$-U is investigated within the framework of relativistic density-functional theory. The energetical stability of $\alpha$-U with CDW distortion is enhanced by the tensile strain along $a$ and $b$ axes, which is similar to the case of negative pressure and normal. However, the tensile strain along $c$ axis suppresses the energetical stability of CDW phase. This abnormal effect could be understood from the emergence of a new one-dimensional atomic chain along $c$ axis in $\alpha$-U. Furthermore, this effect is supported by the calculations of Fermi surface and phonon mode, in which the topological objects and the dynamical instability show opposite behaviors between strains along $a$/$b$ and $c$ axes.     

排名聚合算法在少量长列表聚合中的性能比较分析

排名聚合将多个排名列表聚合成一个综合排名列表,可应用于推荐系统、链路预测、元搜索、提案评选等.当前已有工作从不同角度对不同排名聚合算法进行了综述、比较,但存在算法种类较少、数据统计特性不清晰、评价指标不够合理等局限性.不同排名聚合算法在提出时均声称优于已有算法,但是用于比较的方法不同,测试的数据不同,应用的场景不同,因此何种算法最能适应某一任务在很多情况下仍不甚清楚.本文基于Mallows模型,提出一套生成统计特性可控的不同类型的排名列表的算法,使用一个可应用于不同类型排名列表的通用评价指标,介绍9种排名聚合算法以及它们在聚合少量长列表时的表现.结果发现启发式方法虽然简单,但是在排名列表相似度较高、列表相对简单的情况下,能够接近甚至超过一些优化类方法的结果;列表中平局数量的增长会降低聚合排名的一致性并增加波动;列表数量的增加对聚合效果的影响呈现非单调性.整体而言,基于距离优化的分支定界方法 (FAST)优于其他各类算法,在不同类型的排名列表中表现非常稳定,能够很好地完成少量长列表的排名聚合.     

铜铁镁三掺铌酸锂晶体的第一性原理研究

利用基于密度泛函理论的第一性原理,研究了Cu:Fe:Mg:LiNbO3晶体及对比组的电子结构和光学特性.研究显示,单掺铜或铁铌酸锂晶体的杂质能级分别由Cu 3d轨道或Fe 3d轨道贡献,禁带宽度分别为3.45和3.42 eV;铜、铁共掺铌酸锂晶体杂质能级由Cu和Fe的3d轨道共同贡献,禁带宽度为3.24 eV,吸收峰分别在3.01,2.53和1.36 eV处;Cu:Fe:Mg:LiNbO3晶体中Mg^2+浓度低于阈值或高于阈值(阈值约为6.0 mol%)的禁带宽度分别为2.89 eV或3.30 eV,吸收峰分别位于2.45 eV,1.89 eV或2.89 eV,2.59 eV,2.24 eV.Mg^2+浓度高于阈值,会使吸收边较低于阈值情况红移;并使得部分Fe^3+占Nb位,引起晶体场改变,从而改变吸收峰位置和强度.双光存储应用中可选取2.9 eV作为擦除光,2.5 eV作为读取和写入光,选取Mg^2+浓度达到阈值的三掺晶体在增加动态范围和灵敏度等参量以及优化再现图像的质量等方面更具优势.     

Miscanthus stem fragment – Reinforced polypropylene composites: Development of an optimized preparation procedure at small scale and its validation for differentiating genotypes

The production of ligno-cellulosic biomass-based composites requires the development of new methodologies to evaluate the reinforcement potential of a given biomass, such as miscanthus studied in the work. Miscanthus stems from thirteen genotypes were broken into elongated fragments and mixed with polypropylene composites in an internal mixer. The aim is to find the best protocol able to discriminate miscanthus genotypes for their reinforcement capability. The following process parameters were optimized in order to maximize the reinforcement effect of the stem fragment filler: mixing parameters (mixing time, rotor speed and chamber temperature), temperature, fragment content, size and length distributions and coupling agent. The relationship between the process parameters and the mechanical properties of composites were analyzed to evaluate the influence of genotype on reinforcement performance, showing the robustness of the protocol in effectively discriminating genotypes according to their reinforcing capacity.     

Quantum dots modified with the Al(III)-pefloxacin complex as a novel bioprobe for the sensitive turn-on and dual-fluorescence detection of dsDNA

Microchimica Acta - We describe a novel fluorescent bioprobe for the sensitive and selective detection of double-stranded DNA (dsDNA). It consists of quantum dots (Q-dots) whose fluorescence is...     

Twin-field quantum key distribution based on twisted photon

Quantum key distribution (QKD) is a promising application to establish unconditional secure communications by quantum mechanics. However, its widespread application still faces a great challenge, that is, the fundamental linear key-rate constraint called Pirandola-Laurenza-Ottaviani-Banchi (PLOB) bound. Recently, twin-field QKD (TF-QKD) was proposed (Lucamarini et al., 2018 [4]), it overcomes the constraint mentioned above. However, the original TF-QKD is based on the phase-encoding strategy, which requires active alignment. In this paper, we improve the original TF-QKD with the photon orbital angular momentum (OAM), and propose a novel reference frame independent protocol to overcome the reference frame dependence. No more alignment procedure is needed, and the intrinsic misalignment errors are eliminated by utilizing the rotation-invariance of OAM photons. Besides, the security performance is also improved.