CO分子的A^1Π（v=1）对d^3△（v=5）态的微扰研究

CO谱带的微扰给谱线的标识和分析带来挑战.这里针对CO A1Ⅱ(v=1)对d3△(v=5)态的徵扰,首先采用有效哈密顿矩阵的方法重新分析了d3△-a3Ⅱ(5,0)带高精度的涉及d3△2和d3△3的振转光谱数据,发现A1Ⅱ的微扰可忽略不计.进一步理论计算了由A1Ⅱ的微扰产生的d3△的△1,△2和△3的转动能级移动扣d3△-a3Ⅱ(5,0)光谱强度的变化.发现△1的能级移动最大,最大可达4 cm-1,这个能级移动随J值的增大而减小;对△2和△3的影响在J小时可忽略不计.光谱强度的改变有类似的变化趋势,涉及到△1的d3△1-a3Ⅱ光谱强度减小量最大可达20%,随J的增大,此减小量变小;对涉及△2和△3的光谱强度此微扰可忽略不计,从而给出了上面实验数据分析中不考虑微扰的原因.     

CO三重带系d3Δ-a3Π(4,0)和(5,0)带激光光谱研究

光外差磁旋转浓度调制激光光谱技术属于一种高灵敏度的吸收光谱测量方法 ,可以用于瞬态分子和激发态分子光谱的检测。采用这种技术分别在 16 4 0 0～ 16 6 5 0cm-1和 174 5 0～ 1775 0cm-1波段内直接观测到CO三重带系d3 Δ←a3 Π(4,0 ) (5 ,0 )振转吸收光谱。这种跃迁的上态d3 Δ1(v =4 ) ,d3 Δ2 (v =4 ) ,d3 Δ1(v =5 )分别与A1Π(v =0 ) ,D1Δ(v =0 )和A1Π(v =1)态存在微扰相互作用。通过对所测量到的 CO三重带系 (4,0 ) (5 ,0 )振转谱带作了包含微扰相互作用在内的分析 ,获得了上态d3 Δ(v =4 ,5 )的精确的分子转动光谱常数。     

H2(v=3)+H2(He)碰撞中的转动能量转移

激发态Na2与H2碰撞,使H2(v=3,J=3)得到布居,在H2和He总气压为800Pa及温度为700K的条件下,利用相干反斯托克斯拉曼散射（CARS）光谱技术研究了H2(3,3)与H2(He)间转动能量转移过程。改变CARS激光束与激发Na2的激光之间的延迟时间,测量He不同摩尔配比时H2(3,J)态CARS谱强度的时间演化,得到H2(3,3)的总弛豫速率系数分别为=(21±5)×10-13cm3s-1和=(5.6±1.6)×10-13cm3s-1。测量H2(3,J)各转动态的相对CARS谱强度,由速率方程分析,得到H2(3,3)+H2→H2(3,J)+H2中,对于J=2,4,转移速率系数分别为11±4和8.2±3.1cm3s-1。在H2(3,3)+He→H2(3,J)+He中,对于J=2,4,转移速率系数分别为3.1±1.2和2.1±0.7cm3s-1。对于H2(3,3),单量子弛豫׀∆J׀=1约占该态总弛豫率的90%。     

Na2(A1∑u+,v=8～b3Ⅱ0u,v=14)-Na体系转动传能的碰撞量子干涉效应

沙国河及其工作组于1995年发表了CO A1Π(v=0)～e3∑-(v=1)与He1,Ne及其它碰撞伴的碰撞过程中转动传能的碰撞量子干涉现象,并得到了积分干涉角,陈等从理论和实验上发现了Na2(A1∑u ,v=8～b3Π0u,v=14)体系与Na(3s)碰撞的碰撞量子干涉现象,孙等计算了其积分干涉角,但是对微分干涉角没有过多的计算.本文作为对原子-双原子体系碰撞诱导转动传能的进一步理论研究,在含时一级波恩近似的基础上考虑各向异性相互作用势和长程相互作用势,计算了单叁混合态的Na2(A1∑u ,v=8-bΠ0u,v=14)体系与Na碰撞的微分干涉角,并得到了微分干涉角与碰撞参数的关系,此理论模型对理解和进行分子束实验是非常重要的.     

79BrF和81BrF基态X1Sigma+光谱性质同位素效应对结构性质的影响

采用原子分子静力学的基本原理分析了BrF基态X 1的离解极限,采用Herzberg同位素理论分析了BrF基态X 1光谱数据的同位素效应,并以此为基础,分析了光谱数据的同位素效应对振动能级和分子势能函数（Murrell-Sorbie势即MS势）的影响。结果表明,79BrF和81BrF基态X 1的光谱数据的同位素效应是一种弱效应,与Herzberg同位素理论符合得很好,低振动能态的能级对理论预计的偏离很小,高阶力常数f4和高阶展开系数a3与实验结果有较大偏差,但由于a3本身比a1和a2小很多,结果对势能函数整体影响不大。 关键词：离解极限,光谱数据的同位素效应,振动能级,分子势能函数     

碰撞能对S(1D) +H2(v=0, j=0)→SH+H反应立体动力学性质的影响

利用1A′态的势能面[ Ho et al., J. Chem. Phys. 116, 4124 (2002)]，采用准经典轨线方法研究了在不同碰撞能条件下，S(1D) +H2(v=0, j=0)→SH+H反应的立体动力学性质. 通过计算得到了描述反应物速度矢量k与产物的转动角动量矢量j′这两个矢量相关的分布函数P(r)、描述反应物速度矢量k、产物速度矢量k′与产物的转动角动量矢量j′这三个矢量相关的二面角分布函数P(r)以及描述反应产物角动量极化的分布函数P(r,r).计算结果表明产物的转动角动量矢量j′在空间具有明显的定向和取向效应，并且产物的转动角动量具有强烈的极化. 另外，计算结果还表明这些立体动力学性质对碰撞能非常敏感.     

碰撞能对S(1D) +H2(v=0, j=0)→SH+H反应立体动力学性质的影响

利用1A′态的势能面[ Ho et al., J. Chem. Phys. 116, 4124 (2002)],采用准经典轨线方法研究了在不同碰撞能条件下,S(1D) +H2(v=0, j=0)→SH+H反应的立体动力学性质. 通过计算得到了描述反应物速度矢量k与产物的转动角动量矢量j′这两个矢量相关的分布函数P(r)、描述反应物速度矢量k、产物速度矢量k′与产物的转动角动量矢量j′这三个矢量相关的二面角分布函数P(r)以及描述反应产物角动量极化的分布函数P(r,r).计算结果表明产物的转动角动量矢量j′在空间具有明显的定向和取向效应,并且产物的转动角动量具有强烈的极化. 另外,计算结果还表明这些立体动力学性质对碰撞能非常敏感.     

碰撞诱导振动能量转移：Cs2[B1∏u(v′=5)]+ N2→Cs2[B1∏u(v′=4，6)]+ N2

利用激光诱导荧光方法研究了Cs_2B~1Π_u[(v′=5)]与N2的碰撞能量转移.脉冲激光激发Cs_2基态至B~1Π_u[(v′=5)]态,池温保持在410 K,N_2气压在1.5×10~2 Pa～2.5×10~3 Pa之间变化.荧光中含有直接荧光和碰撞转移荧光成分,记录直接荧光B~1Πu(v′=5)→Χ~1∑~+_g(v″=0)的时间分辨强度.从荧光强度的对数值给出的直线斜率得到B~1Π_u(v′=5)→Χ~1∑~+_g(v″=0)的有效寿命,由Stern-Volmer方程,得到B~1Π_u(v′=5)→Χ~1∑~+_g(v″=0)的辐射寿命为(45±9)ns.B~1Π_u(v′=5)态与N_2碰撞的猝灭总截面为(9.8±1.5)×10~(-15)cm~2.用类似的方法得到B~1Π_u(v′=4,6)能级的辐射寿命.在不同的N_2气压下,测量B~1Π_u(v′=5,4,6)→Χ~1∑~+_g(v″=0)的时间积分荧光强度,首次得到v′=5→v′=4及v′=5→v′=6的碰撞转移截面分别为(3.9±0.8)×10~(-15) cm~2和(4.1±0.8)×10~(-15)cm~2.     

RbH(X1∑+,v=O～2)能级与H2碰撞振动能量转移

利用积分时间分辨荧光光谱方法,研究了RbH(X1Σ+,v=0～2)与H2间的振动碰撞能量转移。在Rb-H2混合样品池中,泵浦激光双光子激发Rb原子至6D态,Rb(6D)与H2反应生成RbH(X1Σ+)分子,探测激光延迟泵浦激光20ns,通过激光感应荧光光谱(LIF)的测量,确定了X1Σ+(v=0～2,J)原生态的转动布居分布。增加检测激光与泵浦激光的延迟时间,测量了0～10μs延迟时间内各振动态时间分辨LIF强度,v=0,1能级荧光信号先增加后缓慢减弱,这是因为RbH在瞬间形成后通过碰撞转移和扩散而减少所致。通过速率方程分析,并利用振动能级上布居数变化与积分时间分辨荧光强度的关系,得到v=1→v=0和v=2→v=1的碰撞转移速率系数分别为(2.8±0.6)×10-11cm3·s-1和(3.4±0.8)×10-11cm3·s-1。而v=0,1,2的扩散率分别为(4.9±1.1)×105,(1.0±0.3)×105,(0.6±0.2)×105s-1。实验表明,v=2能级上布居数衰减率最大。     

He2分子 b3Πg(v=9)态的预解离

利用光外差-浓度调制吸收光谱技术测量了b³Π_g～a³∑_u⁺(9,3)带在12065～12445 cm^-1的光谱,并研究了He₂分子b³Π_g(v=9)态与c³∑_g⁺ 态的预解离相互作用．基于He₂分子c³∑_g⁺ 态的ab initio理论计算势能曲线和b³Π_g态的RKR势能曲线,分析了b³Π_g(v=9)态的预解离机制,并计算了b³Π_g(v=9)态转动能级的预解离线宽,计算结果同实验测量基本一致.     

Chalcogenide Fibers: An Overview of Selected Applications

Chalcogenide glass fibers have many unique properties that make them attractive for applications that are not possible with silica fibers. Selected applications of chalcogenide fibers in research, commerce, and the military are reviewed.     

Some mathematical aspects of Anderson localization: boundary effect,multimodality, and bifurcation

Anderson localization is a famous wave phenomenon that describes the absence of diffusion of waves in a disordered medium. Here we generalize the landscape theory of Anderson localization to general elliptic operators and complex boundary conditions using a probabilistic approach, and further investigate some mathematical aspects of Anderson localization that are rarely discussed before. First, we observe that under the Neumann boundary condition, the low energy quantum states are localized on the boundary of the domain with high probability. We provide a detailed explanation of this phenomenon using the concept of extended subregions and obtain an analytical expression of this probability in the one-dimensional case. Second, we find that the quantum states may be localized in multiple different subregions with high probability in the one-dimensional case and we derive an explicit expression of this probability for various boundary conditions. Finally, we examine a bifurcation phenomenon of the localization subregion as the strength of disorder varies. The critical threshold of bifurcation is analytically computed based on a toy model and the dependence of the critical threshold on model parameters is analyzed.     

辣椒碱与β-环糊精包合物的核磁共振研究

利用核磁共振方法研究了辣椒碱β-环糊精包合物的化学计量比、空间结构信息及其在水溶液中的自扩散系数. 通过测定不同浓度比的辣椒碱和β-环糊精混合溶液的 ¹H NMR数据,绘制Job's曲线,辣椒碱和β-环糊精的Job's曲线均在r=0.5处出现拐点. 同时测定了该包合物的2D ROESY和DOSY谱图,ROESY谱图中NOE交叉信号出现在辣椒碱的H-1~H-8和β-环糊精的H-3′、H-5′、H-6′之间,DOSY测得β-环糊精和辣椒碱形成包合物前后的表观自扩散系数. 结果表明,辣椒碱β-环糊精包合物的主客体分子的化学计量比为1∶1,辣椒碱分子的异丙基端从β-环糊精的宽口端进入疏水腔,其中H-1~H-8部分在空腔内部,包合物的自扩散系数为2.95×10^-10m²/s.     

The ρ-π Puzzle of J/φ and φ′ Decays

The recent BES Collaboration data on φ →PV, particularly the isospin violating mode φ′ → π^oω^o and finding of a finite number for B(φ′ → K^*OK^O), enable us now to deal more precisely about the challenges to theory concerning this extraordinary and remarkableso-called ρ-π puzzle of J/φ and φ′ decays. In terms of the existing data and deploying the simplest phenomenology, measurement of φ′ → π⁺π^- and whether a finite number for the K^*+K^- mode might require a significantly large accumulation of data remain interesting questions.     

HL-2M 装置时序控制与数据采集系统设计

基于 FPGA 和 IEEE1588PTPv2 协议设计了 HL-2M 装置时序控制系统,用于在精准时刻为测控系统 提供触发。数据采集系统采用客户端/服务端双模式管理。在 HL-2M 装置初始等离子体放电实验中测试结果表明, 时序控制和采集系统具有纳秒级精度触发,实时性强,数据传输速度快,稳定可靠,方便部署和管理的特点,满 足 HL-2M 等离子体放电实验的应用需求。     

Interaction of Wave Trains with Defects

The evolution and transition of planar wave trains propagating through defects(obstacles) in an excitable medium are studied. When the frequency of the planar wave trains is increased, three different dynamical regimes,namely fusion, "V" waves, and spiral waves, are observed in turn and the underlying mechanism is discussed. The dynamics is concerned with the shapes of the defects. Circle, triangle, and rectangle defects with different sizes are considered. The increase of pacing frequency broadens the fan-shaped broken region in the behind of a rectangle defect.The increase of width of a triangle defect leads to breakup of wave trains easier while the change of height shows opposite effect, which is presented in a phase diagram. Dynamical comparison on defects with different shapes indicates that the decrease of the defect width along the propagation of wave trains makes the fan-shaped region and the minimal frequency for breakup of spiral both increased.     

环位形下鱼骨模驱动快离子输运的数值模拟研究

考虑包含动理学效应的鱼骨模结构,使用导心轨道程序 ORBIT,在磁面坐标下研究了不同的扰动模 幅度、频率对快离子再分布的影响,并分析了粒子与扰动发生共振的条件。模拟得出,鱼骨模扰动会使快离子在 实空间、相空间中发生再分布,芯部( ψ_p/ψ _w≤0.2 ,ψ_p 为极向磁通,ψ_w 为最后一个闭合磁面的磁通)快离子密 度下降约 20%,中间磁面位置上( ψ_p/ψ _w≥0.2,ψ_p/ψ _w≤ 0.6)的快离子密度增加约 7%;通过扫描频率发现,相空间中快 离子的再分布对模式频率敏感,并分析了快离子与鱼骨模扰动共振的条件。     

Darboux Transformation and N-soliton Solution for Extended Form of Modified Kadomtsev-Petviashvili Equation with Variable-Coefficient

The extended form of modified Kadomtsev-Petviashvili equation with variable-coefficient is investigated in the framework of Painlevé analysis. The Lax pairs are obtained by analysing two Painlevé branches of this equation. Starting with the Lax pair, the N-times Darboux transformation is constructed and the N-soliton solution formula is given, which contains 2n free parameters and two arbitrary functions. Furthermore, with different combinations of the parameters, several types of soliton solutions are calculated from the first order to the third order. The regularity conditions are discussed in order to avoid the singularity of the solutions. Moreover, we construct the generalized Darboux transformation matrix by considering a special limiting process and find a rational-type solution for this equation.     

面向集成模拟平台的远程协作系统

基于 Web 技术,采用三层模型的系统架构,分别使用 AJAX、SQLite、Openlava 和 Python 解决了 数据异步传输、作业结果重用、多用户作业管理和可视化显示等关键技术,成功开发出面向集成模拟平台的远程 协作系统——SICOS。通过 Web 浏览器即可多人同时运行高性能计算集群上 IMAS 框架下的等离子体程序,实 现了程序的集成运行及运行结果的远程分析、数据共享和可视化显示等功能。通过率先集成 EFIT 可以获得 HL-2A 装置实验的平衡位形重建结果和 HL-2M 装置期望的平衡位形结果,为后续其它程序的集成奠定了技术基础。     

Thermodynamics of 4D dS/AdS Gauss–Bonnet black holes according to consistent gravity theory in the presence of a cloud of strings

By looking at the Lovelock theorem one can infer that the gravity model given by [1] cannot be applicable for all types of 4D Einstein–Gauss–Bonnet (EGB) curved space-time. The reason for this is that in 4D space-time, the Gauss–Bonnet invariant is a total derivative and hence it does not contribute to gravitational dynamics. Hence, the authors of [2] presented an alternative consistent EGB gravity model instead of [1] by applying a break-of-diffeomorphism property. In this work, we use the alternative model to produce a de Sitter (dS)/Anti-de Sitter (AdS) black hole metric and then investigate its thermodynamic behavior in the presence of a cloud of Nambu–Goto strings. Mathematical derivations show that the resulting diagrams of pressure vs specific volume at a constant temperature are similar to that for a van der Waals gas/fluid in an ordinary thermodynamic system in the dS sector but not in the AdS background. From this, we infer that the black hole participates in the small-to-large black hole phase transition in the dS background, while it exhibits a Hawking–Page phase transition in the AdS background. In the latter case, an evaporating black hole eventually reaches an AdS vacuum space because of its instability.