Opacity calculations for high-Z plasma in non-local thermodynamic equilibrium

Opacity of high-Z element plasma in non-local thermodynamic equilibrium (NLTE) is calculated. In the calculation, a collisional radiative model in detailed-configuration-accounting (DCA) is applied to population calculations for NLTE plasmas. Configuration-averaged rate coefficients that needed in the rate equations are obtained based on the first order perturbation theory. The Hatree-Fock-Slater self-consistent-field method is used to calculate the electron wave functions. The spin-orbit splitting is included in the spectrum calculations. The unresolved transition array method is used in the opacity calculations. The calculated frequency-dependent opacity of high-Z plasma Lu is presented. The comparison shows that the present spectrum agrees with another theoretical result well except that the present one shifts a little to the lower energy due to its lower mean ionization stage. The effects of highly doubly excited states on ionization balance and on the opacity are investigated. The mean ionization stage increases more than three stages when doubly excited states 5l6l′ and 5l5l′ are not included in the population calculations and the absorption spectrum also shifts to the higher energy.     

The effects of doubly excited states on ionization balance

The effects of highly doubly excited states on ionization balance are investigated. In the calculation, A Collisional-Radiative model in Detailed-Conflguration-Accounting （DCA） is applied to population calculations for NLTE pl＆smas. Configuration-averaged rate coefficients that needed in the rate equations are obtained based onthe first order perturbation theory. The Hatree-Fock-Slater self-consistent-field method is used to calculate theelectron wave functions. The mean ionization stage of high-Z plasma Lu is presented. The comparison shows thatthe mean ionization stage increases more than 3 stages when doubly excited states 5l6l＇ and 5l5l＇ are not included in the population calculations.     

非平衡大气辐射强度与透过率的Line-By-Line计算模式

导出了非局域热力学平衡(NLTE)大气辐射强度与透过率的基本公式,以及NLT和LTE的线强、光学厚度和透过率的关系。假设转动能级是热力学平衡(LTE)的,建立了一个精确的Line-by-LineNLTE辐射强度与透过率的有效算法来计算较高层行星大气红外活跃样品的辐射强度。计算了地球大气¹⁶O₃9.6μm带在白天、夜晚和NLTE、LTE条件下的临边光谱辐射强度、线积分辐射强度、带积分辐射强度和合成光谱辐射强度,揭示了NLTE辐射强度对LTE辐射强度有显著而重要的偏离。     

初始振动态对氢分子离子电离通道的影响

通过数值求解非Born-Oppenheimer近似条件下的一维含时薛定谔方程,理论模拟了H2+在不同核初始振动态条件下(=0到=7)的库仑爆炸核初始动能释放谱。模拟结果表明：强激光场中氢分子离子的电离通道主要包括直接多光子电离、电荷共振增强电离及有中间过程的电荷共振增强电离,并且可以通过选取不同的初始振动态实现对氢分子离子电离通道的控制。     

初始振动态对氢分子离子电离通道的影响

通过数值求解非Born-Oppenheimer近似条件下的一维含时薛定谔方程,理论模拟了H2+在不同核初始振动态条件下(=0到=7)的库仑爆炸核初始动能释放谱。模拟结果表明：强激光场中氢分子离子的电离通道主要包括直接多光子电离、电荷共振增强电离及有中间过程的电荷共振增强电离,并且可以通过选取不同的初始振动态实现对氢分子离子电离通道的控制。     

类铍C III, N IV, O V离子的基态和亚稳态的直接单电离截面计算

本文使用相对论扭曲波近似计算了基态(1s22s2 1S)和亚稳态(2s2p 3P)的类铍C III, N IV和O V离子的电子碰撞直接单电离截面。计算中包括了基态的2s壳层和亚稳态的2s、2p壳层的直接单电离而没有包括1s子壳层。其结果与现有的理论和实验数据进行了比较,相对论扭曲波近似结果在外型和大小上都与近期的实验数据很一致,且与其他理论结果相比,在近阈和高能范围内与实验数据符合得更好。     

Radiative decay of doubly excited states in helium below the He+ (N = 2) ionization threshold

The radiative decay of (1)P(o) doubly excited states in helium has been investigated using a novel apparatus in which metastable atoms and vacuum ultraviolet photons are detected. The intensity ratio of the energetically narrow (sp,2n-)(1)P(o) and (2p,nd)(1)P(o) series to the broader (sp,2n+)(1)P(o) series is strikingly enhanced in comparison with conventional photoabsorption, photoion, or photoelectron measurements using synchrotron radiation. The experimental approach is a new way forward for the study of energetically narrow doubly excited states.     

类铍C III, N IV, O V离子的基态和亚稳态的直接单电离截面计算

本文使用相对论扭曲波近似计算了基态(1s22s2 1S)和亚稳态(2s2p 3P)的类铍C III, N IV和O V离子的电子碰撞直接单电离截面。计算中包括了基态的2s壳层和亚稳态的2s、2p壳层的直接单电离而没有包括1s子壳层。其结果与现有的理论和实验数据进行了比较,相对论扭曲波近似结果在外型和大小上都与近期的实验数据很一致,且与其他理论结果相比,在近阈和高能范围内与实验数据符合得更好。     

Effect of strongly coupled plasma on the doubly excited states of heliumlike ions

The effect of strongly coupled plasma occurring in astrophysical context has been studied for the first time to estimate the energy levels of the autoionizing states of highly stripped astrophysically important ions Al¹¹⁺, Si¹²⁺, P¹³⁺, S¹⁴⁺ and Cl¹⁵⁺ and also C⁴⁺ isoelectronic to helium. The transition energies corresponding to 1s ²:¹S^e → 2s ²:¹S^e, 2p ²:¹D^e, 2s2p:¹P^o, 2s3d:¹D^e and 2p3d:¹F^o are analyzed with respect to different plasma densities using the ion sphere (IS) model of strongly coupled plasma. Transition energies are obtained from the position of the poles of a variational functional based on frequency dependent perturbation calculation probing the collective oscillation modes of the plasma embedded two electron ions. For the free ions corresponding to zero plasma coupling our calculated data agree well with those obtained from spectroscopic data while for the plasma embedded ions the data are new but follow systematic trend. The work has been performed in the domain of linear response theory. The analytical wave function of the doubly excited states have been obtained and may be useful for calculating various transition properties of the plasma embedded ions and also for estimating the rate coefficients for dielectronic recombination processes which play a major role in maintaining equilibrium in high temperature astrophysical or laser produced plasmas.     

Cooper极小值对基态原子多光子电离谱的影响

考虑到残留离子势对末态光电子的影响利用ＨＦＳ自洽场方法和改进的ＫＦＲ方法,研究了在圆偏振强激光场中,基态原子外壳层电子的多光子电离过程。发现在现有条件下,Ｃｏｏｐｅｒ极小值对ｐ、ｄ态电子的多光子电离谱没有影响,或者影响甚微,对ｓ态电子多光子电离谱的影响是广泛和深刻的,而且这一影响的程度与光子的能量和光场强度有较强的依赖关系。     

AuZn和AuAl分子基态与低激发态的势能函数与热力学性质

用密度泛函理论B3LYP方法计算研究AuZn和AuAl分子基态与低激发态的结构与势能函数,导出分子的光谱数据.结果表明,AuZn和AuAl分子基态分别为X²Σ和X¹Σ,基态与低激发态的势能函数均可用Murrell-Sorbie函数来表达.AuZn分子低激发态a⁴Σ的绝热激发能为43529kJ/mol,AuAl分子低激发态a³Σ的绝热激发能为19991kJ/mol.计算固体AuZn和AuAl的内能和熵时,近似以气体分子的电子能和振动能代替固体分子的内能,用电子熵和振动熵代替固体分子的熵.在此近似下,计算得到AuZn和AuAl基态与低激发态固态分子生成反应热力学性质与温度的关系. 关键词： AuZn和AuAl B3LYP 热力学性质 势能函数     

温稠密铝等离子体物态方程及其电离平衡研究

温稠密物质的物性参数在惯性约束聚变能源、Z箍缩等高能量密度物理领域的实验结果分析和物理过程数值模拟等方面有着重要的应用价值.本文应用部分电离等离子体模型,在理想自由能的基础上考虑了库仑相互作用、排斥体积作用和极化作用等非理想特性,开展了温稠密等离子体物态方程和电离平衡的研究.计算了温稠密铝等离子体的压强等物态方程数据和在密度为1.0×10^-4-3.0 g/cm^3,温度为1.0×10^4-3.0×10^4 K范围内的粒子组分.计算结果显示,铝等离子体的平均电离度在临界密度区域内随着密度的增加而突然增大.根据非理想Saha方程中有效电离能这一关键参数,分析了铝等离子体平均电离度在临界密度区域内随密度迅速增大的现象.     

激光脉冲在气体中产生的离化波前的演化及其对光脉冲传播的影响

利用带离化子程序的一维粒子模拟程序，对光脉冲与离化波前的相互作用进行了模拟研究，讨论了在原子多度电离的情况下光脉冲与离化波前的相互作用关系.研究表明，由于原子各级离化势的不连续性使得离化波前在空间上出现平台区；离化过程导致激光频率发生蓝移，这个蓝移又对脉冲形状产生调制，使脉冲前沿呈阶跃型增长；阶跃型的光脉冲包络使离化波前的平台区变短，直至整个离化波前分为几个不同梯度的区域.还讨论了不同元素和不同密度的气体中产生的离化波前的特点.同时分析了光脉冲频率随传播距离的关系，指出由于光脉冲宽度的增加，将导致出射的光 关键词： 激光等离子体 光电离 离化波前 激光频率上转换     

The effect of wave function orthogonality on the simultaneous ionization and excitation of helium

Within the framework of the first-order Born approximation, the triple differential cross sections （TDCSs） for simultaneous ionization and excitation of helium are calculated. The wave function of the ejected electron is chosen to be orthogonal or non-orthogonal to the wave function of the bound electron before ionization. It is found that the orthogonality has a strong effect on the TDCS, especially when plane waves and Coulomb waves are used to describe the projectile and the ejected electron.     

原子多步电离过程中激光功率配置理论研究

从速率方程出发,从理论上研究了原子多步电离过程中激发和电离激光的功率密度合理配置问题.对典型三步三光子电离过程的计算结果表明:在总泵浦激光功率一定条件下,存在一个最佳的激光功率分配方式,这个最佳激光功率分配对应着最高的原子电离几率.给出的结果与以往从饱和激发条件得出结果有很大不同.这里所采用的方法可以推广到更复杂的原子多步激发电离情形.     

Influence of collective effects on lifetimes of condensed excited states

The possibility that collective effects may dramatically influence-limited lifetimes of condensed excitd states is investigated in the context of a two-band model of an insulator in a strong magnetic fiels. Two different mechanisms for suppressing autoionization are discussed which may prevent the potentially catastropic destruction of the excited state. Under appropriate circumstances, he residual low-density Auger electrons may be confined in a superconducting state and paired by excitonic fluctuations in the conduction band.     

Xα交换参数对钠原子激发态能级的影响

在自由电子气近似下,可得到多种不同的交换参数的理论算法.这些理论方法的优劣不能从理论上确定.本文采用SIC-Xα的过渡态算法,利用不同的Xα交换参数理论模型计算了钠原子主线系4p~15p的激发态能级,并与实验结果进行了比较.比较结果表明,在这个体系下,基于Virial定理的理论参数模型明显优于其它理论方法.由此我们找到了一种能给出较为精确的高激发态波函数的简便计算方法,而且能够为研究高激发态原子的外场效应和Rydberg原子结构的精确计算等提供基矢波函数.