Systematic studies on α-decay half-lives for super heavy nuclei

Radioactive decay of super heavy nuclei via the emission of α-particles has been studied theoretically in the preformed cluster model （PCM）. The nucleus-nucleus （NN） potential is obtained by double folding the density distributions of the α-particle and the daughter nucleus with a realistic effective interaction. The M3Y effective interaction, supplemented by a zero-range pseudo-potential for exchange term, is used to calculate the NN potential. The α decay half-lives for 317 nuclei at Z=102 120 are performed in the PCM framework with the theoretical Q values extracted from the MSller-Nix-Kratz and Liran-Marinov-Zeldes mass tables and are compared with the experimental data. The calculated results are also compared with those obtained by using Q values from the Muntian-Hofmann-Patyk-Sobiczewski and Myers-Swiatecki mass estimates.     

Monotone iteration method for differential equations involving integral boundary conditions on the half line

By applying the monotone iterative methods, we obtain the existence of monotone positive solutions for integral boundary value problems of differential equations on the half line, and establish the iterative schemes for approximating the solutions. Our approach is based on the fixed point theorem and the monotone iterative technique. The existence of lower and upper solutions is not needed.     

First-principles calculations to investigate structural,electronic, optical,and transport properties of half-Heusler VFeZ (Z = N and P) compounds

This research work investigates the structural, electronic, optical, and thermoelectric characteristics of VFeZ (Z = N and P) half-Heusler compounds. The study employs the full-potential linearized augmented plane wave (FP-LAPW) method integrated into the WIEN2K algorithm, serving as the underpinning framework for density functional theory (DFT) analysis. In the study, we use the PBE generalized gradient approximation (PBE-GGA) to identify numerous parameters associated with structural and elastic properties. Lattice parameter results are in agreement with previous outcomes. Moreover, computed elastic parameters satisfy the criterion for stability. In the cubic structure VFeZ (Z = N and P) is ductile, to enhance the computations of electronic characteristics, Tran and Blaha's modified Becke-Johnson potential (TB-mBJ) is used. Our simulations demonstrate that the materials exhibit semiconductor behavior, with a direct band gap for VFeZ (Z = N and P). Strong UV absorption is found via optical experiments suggest compounds are suitable for optical application. Furthermore, study of the thermoelectric properties suggests its application in the thermoelectric generators.     

Coulomb‐enhanced spin–orbit coupling and semiconductor to half‐metal transition under pressure in Sr2CrReO6

Ordered Sr₂CrReO₆ has been synthesized recently. It is measured to be ferrimagnetic semiconductor, in contrary to the previous reports of metallic properties. To solve the discrepancy, we have investigated the compound by using the density functional theory. The semiconducting behavior is reproduced by including the electron correlation and spin–orbit coupling simultaneously. The calculated band gap is 0.22 eV, close to the experimental value of 0.21 eV. A large orbital moment of 0.69µ_B is found for Re, which is caused by the Coulomb‐enhanced spin–orbit coupling. By applying pressure, a semiconductor to half‐metal transition is observed through 5% volume compression.

     

On Finite 2‐Path‐Transitive Graphs

The class of graphs that are 2‐path‐transitive but not 2‐arc‐transitive is investigated. The amalgams for such graphs are determined, and structural information regarding the full automorphism groups is given. It is then proved that a graph is 2‐path‐transitive but not 2‐arc‐transitive if and only if its line graph is half‐arc‐transitive, thus providing a method for constructing new families of half‐arc‐transitive graphs. © 2012 Wiley Periodicals, Inc. J. Graph Theory 73: 225–237, 2013     

海森堡群上半空间内最佳Hardy不等式

证明了一类海森堡群上半空间内与次拉普拉斯算子相关的最佳Hardy不等式.作为应用,我们得到了相应的最佳Rellich型不等式.     

Ground State Properties of Superheavy Nuclei in Macroscopic-Microscopic Model

The ground state properties of superheavy nuclei are systematically calculated by the macroscopic- microscopic （MM） model with the Nilsson potential. The calculations well produced the ground state binding energies, α-decay energies, and half lives of superheavy nuclei. The calculated results are systematically compared with available experimental data. The calculated results are also compared with theoretical results from other MM models and from relativistic mean-field model. The calculations and comparisons show that the MM model is reliable in superheavy region and that the MM model results are not very sensitive to the choice of microscopic single-particle potential.     

Photoinduced electron transfer between hen egg white lysozyme and anticancer drug menadione

The protein, hen egg white lysozyme, on photoexcitation undergoes electron transfer with menadione (2-methyl-1,4-naphthoquinone), a widely known anticancer drug. With the addition of menadione the fluorescence of lysozyme is quenched with the simultaneous formation of an excited state charge-transfer complex in the longer wavelength and a ground state complex. The former is further evident from laser flash photolysis studies, which indicate a tryptophan to menadione electron transfer. From fluorescence quenching studies the binding constant is found to be ∼1.7×10⁴ M⁻¹ with the corresponding changes in enthalpy (ΔH°) and entropy (ΔS°) as 12.24 kJ mol⁻¹ and 124.12 J mol⁻¹ K⁻¹, respectively, indicative of an entropy-driven process. The circular dichroism studies also show some structural changes with increase in α-helical content in the protein on interaction with menadione. Finally, docking studies give some insight into the role of Trp 108 of lysozyme in the interaction.     

Onset of itinerant ferromagnetism associated with semiconductor-metal transition in Ti<Subscript><Emphasis Type="Italic">x</Emphasis></Subscript>Nb<Subscript>1 − <Emphasis Type="Italic">x</Emphasis></Subscript>CoSn half Heusler solid solution compounds

In this paper, the magnetic and transport properties of the Ti _x Nb_{1 − x} CoSn solid solution compounds with half Heusler cubic MgAgAs-type structure have been studied. This work shows the onset of ferromagnetism associated with a semiconductor to metal transition. The transition occurs directly from ferromagnetic metal to semiconducting state as it is the case in the TiCo _x Ni_{1 − x} Sn series studied previously. A weak quantity of Ti in NbCoSn is suffcient to allow the appearance of ferromagnetic order and metallic state. The variations of the Curie temperature as a function of saturation and effective paramagnetic moments are related to the itinerant ferromagnetism model. A comparison is made with the TiCoSn _x Sb_{1 − x} series (also studied previously), where the transition from TiCoSn ferromagnetic metal to non-magnetic semiconductor TiCoSb occurs through an intermediate metallic Pauli-like state.      

半空间上水平层状场地自振频率计算方法比较

为避免结构物与场地地基的共振效应,基于传统波速法、一致质量矩阵剪切质点系法及剪切梁法的基本原理,分析和比较了各方法计算场地自振频率的计算精度和影响因素.结果表明:传统波速法不能反映土层剖面结构特征的影响,而且仅在土层剖面在深度方向较为对称的情况下才能获得工程可接受的精度;一致质量矩阵剪切质点系法则表现出计算稳定、精度高的特点,且作为一种离散方法,具有良好的计算适应性和灵活性.