原子光纤中物质波演化的唯象描述

最近,Luo等人在实验上实现了所谓的原子光纤技术(原子物质波沿着一个25μm长的螺旋型波导走完了完整的两圈路径)。本文替该弯曲原子光纤中物质波的时间演化量子力学过程提供了一个唯象描述,主要讨论了三个相关问题：(i)原子物质波与弯曲波导相互作用的有效哈密顿量的构造;(ii)获得描述弯曲原子光纤中物质波的波函数;(iii)证明该物质波波函数恰好是原子动量算符的本征态,表明该唯象描述是自洽的。我们认为本文的唯象模型对于所谓的“原子光学”(atom optics)的研究是有一定意义的。     

The uncertainties in radial position and radial momentum of an electron in the non-relativistic hydrogen-like atom

Similar to the case of a simple harmonic oscillator, an increase in azimuthal quantum number l will result in simultaneous decrease in both the uncertainty in radial position and the uncertainty in radial momentum for the same principal quantum number n in the non-relativistic hydrogen-like atom. Thus, in some cases of hydrogen-like atom and in the case of a simple harmonic oscillator, the more precisely the position is determined, the more precisely the momentum is known in that instant, and vice versa.     

The entropy of a single large finite system undergoing both heat and work transfer

Computing the entropy of a system from a single trajectory is discussed when the energy exchange with the environment includes both mechanical and thermal terms. The physical example chosen as an illustration is a cluster of atoms impacting a hard surface. Each atom of the cluster interacts with the smooth surface by a momentum transfer using the hard cube model [E. K. Grimmelmann, J. C. Tully and M. J. Cardillo, J. Chem. Phys. 72, 1039 (1980)]. Because of the thermal motion of the surface atoms the atoms of the cluster rebound from the surface with a (random) thermal component to their momentum. The change in the internal energy of the cluster has therefore both a mechanical, work, term and a heat transfer and the heat term contributes to the change in entropy of the cluster but the major contribution is the loss of potentially available work.     

Adiabatic motion of an atomic chain in periodic potential

The adiabatic motion of a finite chain of atoms interacting in accordance with next-neighbour harmonic forces and placed in a periodic external potential (the Frenkel-Kontorova model) is investigated. The conditions are determined where the activation energy of the chain motion is lower than that of the motion of a single atom. The results are used to explain some experimental data on surface diffusion in chemisorbed systems.     

Dissociation of a product of a surface reaction in the gas phase: XeF2 reaction with Si

Xenon difluoride interacts with Si(100)2 x 1 by atom abstraction, whereby a dangling bond abstracts a F atom from XeF2, scattering the complementary XeF. Partitioning of the reaction exothermicity produces sufficient XeF rovibrational excitation for dissociation to occur. The resulting F and Xe atoms are shown to arise from dissociation of XeF in the gas phase by demonstrating that the angle-resolved velocity distributions of F, Xe, and XeF conserve momentum, energy, and mass. This experiment documents the first observation of dissociation of a surface reaction product in the gas phase.     

Path of Momentum Integral in the Skorniakov-Ter-Martirosian Equation

The Skorniakov-Ter-Martirosian (STM) integral equation is widely used for the quantum three-body problems of low-energy particles (e.g., ultracold atom gases). With this equation these three-body problems can be efficiently solved in the momentum space. In this approach the boundary condition for the case that all the three particles are gathered together is described by the upper limit of the momentum integral, i.e., the momentum cutoff. On the other hand, in realistic systems, the three-body recombination (TBR) process can occur when all these three particles are close to each other. In this process two particles form a deep dimer and the other particle can gain high kinetic energy and then escape from the low-energy system. In the presence of the TBR process, the momentum-cutoff in the STM equation would include a non-zero imaginary part. As a result, the momentum integral in the STM equation should be done in the complex-momentum plane. In this case the result of the integral depends on the choice of the integral path. Obviously, only one integral path can lead to the correct result. In this paper we consider how to correctly choose the integral path for the STM equation. We take the atom-dimer scattering problem in a specific ultracold atom gas as an example, and show the results given by different integral paths. Based on the result for this case we explore the reasonable integral paths for general case.     

Electromagnetic momenta and forces in dispersive dielectric media

When the effects of dispersion are included, neither the Abraham nor the Minkowski expression for electromagnetic momentum in a dielectric medium gives the correct recoil momentum for absorbers or emitters of radiation. The total momentum density associated with a field in a dielectric medium has three contributions: (i) the Abraham momentum density of the field, (ii) the momentum density associated with the Abraham force, and (iii) a momentum density arising from the dispersive part of the response of the medium to the field, the latter having a form evidently first derived by Nelson (1991) [8]. All three contributions are required for momentum conservation in the recoil of an absorber or emitter in a dielectric medium. We consider the momentum exchanged and the force on a polarizable particle (e.g., an atom or a small dielectric sphere) in a host dielectric when a pulse of light is incident upon it, including the dispersion of the dielectric medium as well as a dispersive component in the response of the particle to the field. The force can be greatly increased in slow-light dielectric media.     

势阱中玻色-爱因斯坦凝聚气体的势场有效性和粒子数极限判据

基于最小动量态上的玻色-爱因斯坦凝聚(简称BEC)，给出了指数吸引势场中超冷玻色原子气体的势场有效性和势阱中所装载的原子数目极限判据.此判据给出了当所装载的原子数确定时，所需要的势场强度；或势场给定时，所装载的原子数目的极限. 关键词： 玻色-爱因斯坦凝聚 临界温度 最小动量态     

Origin of orbital ferromagnetism and giant magnetic anisotropy at the nanoscale

The origin of orbital magnetism recently observed in different nanostructured films and particles is discussed as a consequence of spin-orbit coupling. It is shown that contact potentials induced at the thin film surface by broken symmetries, as domain boundaries in self-assembled monolayers, lead to orbital states that in some cases are of large radius. The component of the angular momentum normal to the surface can reach very high values that decrease the total energy by decreasing spin-orbit interaction energy. Intraorbital ferromagnetic spin correlations induce orbital momenta alignment. The estimated values of the magnetic moments per atom are in good agreement with the experimental observations in thiol capped gold films and nanoparticles.     

High-efficiency detection of a single quantum of angular momentum by suppression of optical pumping

We propose and demonstrate experimentally the discrimination between two spin states of an atom purely on the basis of their angular momentum. The discrimination relies on angular momentum selection rules and does not require magnetic effects such as a magnetic dipole moment of the atom or an applied magnetic field. The central ingredient is to prevent by coherent population trapping an optical pumping process which would otherwise relax the spin state before a detectable signal could be obtained. We detected the presence or absence of a single quantum (h) of angular momentum in a trapped calcium ion in a single observation with success probability 0.86. As a practical technique, the method can be applied to read out some types of quantum computer.     

磁阱中超冷玻色气体临界行为的观测

超冷玻色气体为研究量子临界现象提供了一个非常干净的实验系统. 弱相互作用下的三维玻色气体的临界行为与⁴He发生超流相变时的临界行为类似, 都属于三维XY型普适类. 从正常流体到超流的量子相变过程中, 系统会经历一个从无序相到长程有序相的转变; 而在相变点附近, 系统参量会表现出一些奇点的特征. 本文从实验上观测到了静磁阱中超冷⁸⁷Rb玻色气体在凝聚体相变温度T_c附近的临界行为. 原子气体从静磁阱中释放, 经过30 ms的自由飞行后, 通过吸收成像得到原子气体的动量分布; 然后从中扣除热原子气体的动量分布, 提取出空间上处于临界区域内的原子气体动量分布, 并对不同温度下的动量分布半高宽进行统计. 统计结果显示: 在非常接近相变温度T_c时, 动量分布的半高宽突然减小, 表现出十分明显的奇点行为.     

囚禁弱相互作用玻色气体的势场优化准则

根据Thomas-Fermi近似,在基于最小动量态上玻色-爱因斯坦凝聚的前提下,研究了囚禁弱相互作用玻色气体势场的最优化问题.导出了指数吸引势阱中有效势场和粒子数极限判据,粒子数给定时,可由此判据求出所需势场强度;势场强度给定时,可由此判据求出粒子数极限.根据吸引相互作用系统的稳定性以及求出的排斥相互作用的最大粒子数极限,结合有效势场判据,分别给出了囚禁吸引和排斥相互作用玻色气体时,势场强度的最佳取值范围. 关键词： 玻色-爱因斯坦凝聚 弱相互作用 粒子数极限 势场强度     

Coherence properties of two trapped particles

We analyse the coherence properties of two particles trapped in a one-dimensional harmonic potential. This simple model allows us to derive analytic expressions for the first and second order coherence functions. We investigate their properties depending on the particle nature and the temperature of the quantum gas. We find that at zero temperature non-interacting bosons and fermions show very different correlations, while they coincide for higher temperatures. We observe atom bunching for bosons and atom anti-bunching for fermions. When the effect of s-wave scattering between bosons is taken into account, we find that the range of coherence is enhanced or reduced for repulsive or attractive potentials, respectively. Strongly repelling bosons become in some way more “fermion-like" and show anti-bunching. Their first order coherence function, however, differs from that for fermions. Received 19 September 2002 Published online 4 February 2003     

Bosonization, pairing, and superconductivity of the fermionic Tonks-Girardeau gas

We determine some exact static and time-dependent properties of the fermionic Tonks-Girardeau (FTG) gas, a spin-aligned one-dimensional Fermi gas with infinitely strongly attractive zero-range odd-wave interactions. We show that its two-particle reduced density matrix exhibits superconductive off-diagonal long-range order, and on a ring an FTG gas with an even number of atoms has a highly degenerate ground state with quantization of Coriolis rotational flux and high sensitivity to rotation and to external fields and accelerations. For a gas initially under harmonic confinement, we show that during an expansion the momentum distribution undergoes a "dynamical bosonization," approaching that of an ideal Bose gas without violating the Pauli exclusion principle.     

三维各向同性谐振子的几何动量分布

尽管几何动量最初的引入是为了描述超面上的运动粒子的动量,却不需要限制在真实的曲面上.如果一个曲线坐标系包含了超面族和超面上的法向矢量作为一个坐标轴的单位矢量,几何动量可以定义在超面族上,并参与构造对易力学量完全集.在三维各向同性谐振子中,采用球坐标描述,存在等效球面,并在球面族上建立对易力学量完全集.因此,三维各向同性谐振子同时具有动量和几何动量分布.这两个动量的差,可以定义为径向动量,从而使得径向动量可以测量.那么,通过几何动量,可以显示出狄拉克引进的径向动量的物理意义,而不是一直认为的那样完全不具有观测意义.     

Harmonic Enhancement Mechanism of a Superposition State Atom Irradiated by Short Pulses

We investigate the high-order harmonic generation （HHG） of a model atom whose initial state is prepared in a superposition of its ground state and an excited state irradiated by different duration laser pulses. Compared to the HHG generated from an atom whose initial state is in its ground state, its conversion efficiency obtains some enhancement. The enhancement originates from the higher ionization rate （rather than the ionization yield） of the atom with superposition initial state.     

气体-表面相互作用的分子动力学模拟研究

采用分子动力学模拟方法研究了气体分子Ar在光滑和粗糙Pt表面上的散射规律.提出了一种速度抽样方法,计算了不同温度条件下气体分子对光滑和粗糙表面的切向动量适应系数和吸附概率.结果显示：光滑表面条件下,气体分子的切向动量系数和吸附概率都随着温度的升高而降低;粗糙度对气体分子切向动量与表面的适应具有极大的促进作用,当粗糙度足够大时,切向动量适应系数的大小趋近于1.0,对温度的敏感性也逐渐降低.采用粒子束方法对气体分子在光滑和粗糙表面上的散射规律进行了定量分析.总结了散射过程中气体分子的典型轨迹和动量变化规律,将气体分子在光滑表面的散射分为两种类型：单次碰撞后散射和多次碰撞后散射.单次碰撞后散射的气体分子平均切向动量有所减小,而经过多次碰撞后散射的气体分子则倾向于保持原有的平均切向动量.对于粗糙表面,粗糙度的存在使气体分子与表面间的动量和能量适应更加充分,导致气体分子在较粗糙表面上散射后的平均切向动量大幅减小并接近于0,且气体分子在表面上经历的碰撞次数越多,其散射后的能量损失越严重.     

液体横向射流在气膜作用下的破碎过程

为了研究液体横向射流在气膜作用下的破碎过程,采用背景光成像技术及VOF TO DPM方法进行了实验研究和仿真研究,模拟介质为水和空气.研究结果表明,液体射流在气膜作用下主要存在两种破碎过程:柱状破碎和表面破碎.Rayleigh-Taylor(R-T)不稳定性产生的表面波是液体射流发生柱状破碎的主要原因,气流穿透表面波的波谷导致射流柱破碎,破碎后的液丝沿流向逐渐发展呈带状分布.Kelvin-Helmholtz(K-H)不稳定性产生的表面波是液体射流发生表面破碎的主要原因,液丝和液滴从射流表面剥离.局部动量比对液体横向射流的破碎过程具有重要影响,当局部动量比较低时,液体射流的破碎由K-H不稳定性主导;随着局部动量比的增大液体射流的破碎逐渐由R-T不稳定性主导.液体射流的破碎长度及穿透深度均随局部动量比的增大而增大.     

Single Ultrashort Attosecond Pulse Generation via Combination of Chirped Fundamental Laser and an Ultraviolet Controlling Pulse

We theoretically study the high-order harmonic generation (HHG) from a hydrogen atom in an intense few-cycle chirped fundamental laser in combination with an ultraviolet (uv) controlling pulse.The high-order harmonic spectrum is calculated by solving the time-dependent Schr¨odinger equation using the split-operator method.In our calculation,we present the difference of the high-order harmonic spectrum from one-dimensional (1D) model hydrogen atom and three-dimensional (3D) real hydrogen atom.We found that the plateau of the high-order harmonic generation from the 1D case and 3D case are all extended effectively to I p + 35U p due to the presence of the chirped laser pulse and the HHG supercontinuum spectrum is generated by adding an ultraviolet controlling pulse at a proper time,but the efficiency of the HHG for 3D case is more higher at the near cut-off region than the 1D case.Therefore,the generation of the attosecond pulse by synthesizing the harmonics near cut-off region have some slight differences between 1D and 3D simulations.As a real 3D case study,we show that an isolated 18 as pulse with a bandwidth of 232.5 eV is generated directly by optmizing the combination laser fields.     

A simple quantum chemical theory of dissociative adsorption

Potential energy curves for the adsorption of a hydrogen atom on the (100), (110), (111) and the stepped (311) crystal faces of copper have been calculated in the pairwise additive model for gas atom-solid interactions. A Morse function is used to represent the lowest singlet pairwise H-Cu interaction potential and its parameters are adjusted so that the calculated maximum bond energies conform with the available experimental data. Bond strength on the low index faces is found to increase with the adatom's local coordination number. Except for the edge sites, the steps on the (311) surface strengthen the bonds to sites on the component low index facets. A systematic study of the convergence of the bond energy as a function of the number of solid atoms is reported. The H-Cu(s) potential is shown to be relatively insensitive to changes in the first layer separation distance of the size inferred from experiment. A new model for diatom-solid potentials is proposed in which the diatom-solid potential is expressed as a sum of the differences between diatom-solid atom London-Eyring-Polanyi-Sato three-body potentials and the diatom singlet potential. This model is used to calculate potential curves for various approaches of a hydrogen molecule towards the same copper faces. H₂ is predicted to be physisorbed on each face. The atom-solid and diatom—solid potentials are used in conjunction with a model formulated by Lennard-Jones to estimate activation energies for dissociative adsorption. The correct order is obtained for the activation energies on the low index faces. Substantially lower activation energies are obtained for approaches toward many of the sites on the two low index facets of the (311) surface as compared to the same approaches towards the individual component faces. Dissociative adsorption is predicted to proceed without activation near the steps on this surface. In general, higher activation energies are obtained when the admolecule is perpendicular to the surface or facet in question. The simple idea that the activation energies are determined by small shifts of the atomic potential relative to the less structure-sensitive molecular potential works well for the low index faces, but is not wholly satisfactory for the stepped (311) surface. All results reported in this paper are negligibly different from those that are fully converged with respect to cluster size in the present model.