Complete numerical solution of electron-hydrogen model collision problem above the ionization threshold

Benchmark results are presented for electrons colliding with hydrogen atoms in the S-wave (Temkin-Poet) model collision problem, which neglects angular momentum. Complete results (elastic, inelastic, and ionization), accurate to 1%, are obtained by numerically integrating Schrodinger's equation subject to correct asymptotic boundary conditions. This marks the first time direct matching to asymptotic boundary conditions has been shown to yield convergent ionization amplitudes for a Coulomb three-body problem. Results are presented for impact energies of 54.4 and 40.8 eV, where comparison with other theories is available.     

K-shell single-electron capture in collision of fast protons with multi-electron atoms

Single-electron capture from the K shell of atomic targets by impact of protons at moderate and high energies has been studied using a first-order three-body Coulomb-Born continuum distorted wave approximation. The applied formalism satisfies the correct Coulomb boundary conditions. Single-zeta Roothaan-Hartree-Fock wave functions are used to describe the initial electronic bound state of the exchanged electron. Both differential and integral capture cross sections are calculated for impact of protons on carbon, nitrogen, oxygen, neon and argon atoms. The results are compared with the available measurements and other theories. The agreement between the calculations and experimental data is remarkable.     

Reflection amplitudes of boundary Toda theories and thermodynamic Bethe ansatz

We study the ultraviolet asymptotics in A_n affine Toda theories with integrable boundary actions. The reflection amplitudes of non-affine Toda theories in the presence of conformal boundary actions have been obtained from the quantum mechanical reflections of the wave functional in the Weyl chamber and used for the quantization conditions and ground-state energies. We compare these results with the thermodynamic Bethe ansatz derived from both the bulk and (conjectured) boundary scattering amplitudes. The two independent approaches match very well and provide the non-perturbative checks of the boundary scattering amplitudes for Neumann and (+) boundary conditions.     

Effect of the Wigner-Seitz boundary conditions on internal conversion coefficients

Solid state effects are taken into account in an internal conversion coefficients computation by using Wigner-Seitz boundary conditions. Both the bound and free electron wave functions are calculated from an atomic Dirac-Hartree-Fock-Slater self consistent potential. These internal conversion coefficients are compared with those obtained from the usual free atom boundary conditions.     

Hartree-Fock approximation for the one-dimensional electron gas

The Hartree-Fock calculation on the one-dimensional electron gas is done on the basis of the method analogous to that applied by Bloch and Wigner and Seitz for the three-dimensional gas. The boundary conditions of the standing wave are taken for the wave function and the bare Coulomb interaction between electrons is assumed. The parameterr _s of the three-dimensional gas is replaced by the ratio between the cross-section radius and the length of the potential tube filled by the one-dimensional gas. Excepting for a special case of the excitement of an electron pair put on one electron level the excitation energies of the non-magnetic gas are found to be very much higher than these of the ferromagnetic gas. A similar relation holds between the ground state energies of the non-magnetic and magnetic gases.     

共面双对称条件下电子碰撞Ar原子单电离的一阶扭曲波Born近似

在共面双对称几何条件下,利用一阶扭曲波Born近似计算了中低能电子碰撞Ar原子(3p壳层电子)单电离的三重微分截面,并与最近的实验数据做了比较.结果表明,对于Ar原子,当入射电子能量比电离阈高40 eV以上,随着入射能量的增加,binary和recoil碰撞机理逐渐占据支配地位;在近阈能量范围,上述碰撞机理不再处于支配地位,扭曲效应明显.要完备地描述中低能入射条件下Ar原子的电子碰撞电离过程,理论模型必须同时考虑多种散射机理.     

低碰撞能下Li+HF(v=0－3，j=0－40)→LiF+H反应的立体动力学研究

基于2003年势能面,运用准经典轨线法(QCT)研究Li+HF→LiF+H反应立体动力学.探究较低碰撞能(1.15 kcal·mol-1-5.00 kcal·mol-1)下碰撞能、振转激发对极化微分反应截面(PDDCSs)和三矢量相关的P(θr,r)分布函数的影响,将积分散射截面与已有的理论及实验结果比较.结果显示,在较低碰撞能下碰撞能、振转激发对极化微分散射截面和三矢量相关的P(θr,r)分布函数有影响,但振转激发对极化微分反应截面和P(θr,r)分布的影响更大,碰撞能的增加使产物转动角动量后向散射的极化强度增大.在计算的能量范围内积分散射截面与其它的理论及实验结果符合较好.     

推广Bethe公式：Au50+离子的偶极激发的碰撞强度和速率系数

快速算法结合推广的Bethe公式,可以为应用研究提供便于使用的偶极激发碰撞强度和速率系数.用准相对论平面波Born(QRPB)近似计算高能区Au⁵⁰⁺离子n₀l₀→nl偶极激发的碰撞强度,给出Bethe公式中动量转移截断参数k₀,从而确定激发过程的高能行为.快速计算方法中采用了Cowan所发展的准相对论方法,用统一的Hartree-Fock-Slater势计算束缚和连续态电子波函数.用准相对论扭曲波(QRDW)近似计算阈值附近的碰撞强度并外推阈值处的碰撞强度Ω₀,然后拟合到高能碰撞强度上.对于特殊情况还需增加三倍阈值点a的计算,用三个参数Ω₀,Ω_a和k₀拟合出全能域(出射电子能量ε_b=0—∞)的碰撞强度.由此可以得到全部温度范围(电子温度T_e=0—∞)的速率系数<σv>.这样得到的Ω和<σv>,在相应的感兴趣的能量和温度范围内有合理的精度. 关键词：     

类He离子的电子碰撞激发截面

利用扭曲波方法计算类He离子的电子碰撞激发截面。靶波函数采用HFS自洽场波函数,本文计算了若干元素从基态(1¹S)到2¹S,2¹P,2³S,2³P的跃迁。计算结果以碰撞强度的形式给出。入射电子能量从激发阈能开始到x=10,计算结果与已有的结果作了比较,分析表明,在大多数情况下,结果是满意的。     

Kinetics and dynamics of the S(1D2) + H2 → SH + H reaction at very low temperatures and collision energies

We report combined studies on the prototypical S(1D2) + H2 insertion reaction. Kinetics and crossed-beam experiments are performed in experimental conditions approaching the cold energy regime, yielding absolute rate coefficients down to 5.8 K and relative integral cross sections to collision energies as low as 0.68 meV. They are supported by quantum calculations on a potential energy surface treating long-range interactions accurately. All results are consistent and the excitation function behavior is explained in terms of the cumulative contribution of various partial waves.     

Attenuation characteristics of obliquely incident electromagnetic wave in weakly ionized dusty plasma based on modified Bhatnagar–Gross–Krook collision model

The attenuation characteristics of obliquely incident electromagnetic(EM) wave in L-Ka frequency band in weakly ionized dusty plasma are analyzed based on the modified Bhatnagar-Gross-Krook(BGK) collision model.According to the kinetic equation and the charging theory,the total complex dielectric constant of the weakly ionized dusty plasma is derived by considering that the minimum velocity of the electron accessible to the dust particle surface is non-zero and the second potential part of the collision cross-section contributes to the charging.The attenuation characteristics within the modified model are compared with those within the traditional model.The influence of the dusty plasma parameters and the incident angle of EM waves on the attenuation in weakly ionized dusty plasma is further analyzed.Finally,the influence of different reentry heights on the attenuation characteristics of the obliquely incident EM wave is discussed.The results show that the effect of the minimum electron velocity and the second term of the collision cross-section on the attenuation characteristics of EM waves cannot be ignored.When the dust density and dust radius are changed,the trends of the attenuation of obliquely incident EM waves are consistent,but the influence of dust density is weaker than that of dust radius due to the constraint of orbit-limited motion(OLM) theory.The plasma thickness,electron density,and incident angle are proportional to the attenuation amplitude of EM waves.The effect of different reentry heights on the attenuation obliquely incident EM waves is related to the electron density and plasma thickness.     

聚乙炔的能带结构和长程关联能的计算

本文计算了在考虑电子-电子Coulomb相互作用情况下的导电聚合物聚乙炔的长程关联能(分周期边界条件和自然边界条件两种情况),与用其它方法得到的结果进行比较,结果符合很好,讨论了关联能对带隙的影响.     

聚乙炔的能带结构和长程关联能的计算

本文计算了在考虑电子-电子Coulomb相互作用情况下的导电聚合物聚乙炔的长程关联能（分周期边界条件和自然边界条件两种情况），与用其它方法得到的结果进行比较，结果符合很好，并且讨论了关联能对带隙的影响。     

FDTD Simulation of Electromagnetic Reflection of Conductive Plane Covered with Imhomogeneous Time-Varying Plasma

A finite-difference time-domain (FDTD) algorithm is applied to study the electromagnetic reflection of conduction plane covered with inhomogeneous, collision, warm, time-varying plasma. The collision frequency of plasma is a function of electron density and plasma temperature. Under the one-dimensional case, transient electromagnetic propagation through various plasmas have been obtained, and the reflection coefficient of EM wave through inhomogeneous time-varying plasma (ITVP), homogeneous time-varying plasma (HTVP) and inhomogeneous plasma (IP) are calculated under different conditions. The results illustrate that a plasma cloaking system can successfully absorb the incident EM wave.     

Splitting of strain solitons upon their interaction

The results from analytical studies and numerical simulations of strain soliton interaction are presented. It is shown that soliton collisions are of an inelastic character; i.e., secondary (daughter) solitons with lower energies are produced after a collision, and either the residual energy is spent in a wave process, or additional secondary solitons can form if the energy is sufficient. Qualitatively different scenarios of this interaction depend on the relative velocity of collision. Elements of visualizing nonlinear wave processes via shadowgraphy are discussed.     

基于AKEBONO哨声波参数的内辐射带高能电子扩散模拟

为能准确地模拟内辐射带中哨声波对高能电子扩散损失的影响,基于内辐射带AKEBONO哨声波参数统计模型,及随纬度分布的背景冷等离子体密度模型,对引起电子扩散损失的大气分子,空间等离子体嘶声、闪电激发的哨声、人工激发的甚低频三类哨声波,利用准线性扩散理论,计算1.4≤ L≤2.0区域的不同能量电子,受到库仑碰撞和波粒回旋共振相互作用的弹跳周期平均赤道投掷角扩散系数,分析不同作用机制、不同类哨声波、不同能量、不同磁壳参数等对辐射带高能电子扩散损失的影响.结果表明：在赤道面损失锥角附近,高能电子主要受到库仑碰撞作用而扩散;在赤道投掷角接近90°附近区域,等离子体嘶声和闪电激发的哨声是引起扩散的主要因素;内辐射带电子主要受到甚低频电磁波波粒回旋共振扩散影响;扩散系数对高能电子能量及其所处磁壳参数比较敏感,通常,高能电子的能量或所处磁壳参数越大,扩散系数越大.     

Double electron capture cross-sections by protons in collisions with He

Double electron capture (DEC) by protons from He was studied in collisions at energies in the keV regime, theoretically and experimentally. Theoretical cross-sections were calculated using the electron nuclear dynamic approach and a binomial distribution method in the energy range 1–100 keV. Experimental cross-sections were measured by means of the grow-rate method in the energy range of 4–10 keV. The cross-sections measured are consistent with those of the previous data at the high energies of the measured interval and show a different trend for the low energy. This behavior is consistent with those of other DEC cross-sections measured by protons from He-like targets. With the two collision models, it is proven that the reference data for this system are consistent only with the assumption of uncorrelated electrons and with independent target-projectile nuclei dynamics.     

估算等离子体效应对类氢离子束缚态能级能量影响的新公式

在均匀电子气模型下,通过求解Dirac方程,计算了类氢离子束缚态能级能量与等离子体密度的关系,得到了能近似估算能级能量随等离子体密度变化的新拟合公式,该公式同样可以用以估算不同束缚态能级发生压致电离时的临界电子密度.通过与自洽场离子球模型计算结果的比较,作为一种简单和快捷的计算方法,均匀电子汽模型在近似计算束缚态能级能量及压致电离临界电子密度方面是自洽场离子球模型得很好近似方法.