采用Ag+离子与TiF6光学玻璃内的K+或Na+离子交换产生高折射率梯度剖面分布

本文介绍了TiF₆光学玻璃的制作。研究了这种玻璃内的K⁺或Na⁺离子与Ag⁺离子交换。使用双光束干涉法观测了干涉纹、并用电子探针扫描电镜测量了Ag⁺、K⁺和Na⁺离子的浓度分布,还着重研究了离子交换后的玻璃裂纹和着色问题。最后,对结果作了讨论。     

辅助光对NaCl(OH-)和KCl(Na+,OH-)晶体中的类F2+型色心激光输出的影响

文中报进了有关辅助光对NaCl(OH^-):(F₂⁺)_H及KCl(Na⁺,OH^-):(F₂⁺)_AH色心激光输出功率影响的主要研究结果。初步探讨了辅助光作用的物理机制。     

二价Ba2+、Pb2+和四价Ti4+在硼硅酸盐玻璃系统中对Li+/Na+离子交换的影响

本文讨论了在硼硅酸盐玻璃系统中引入二价Ba²⁺、Pb²⁺和四价Ti⁴⁺后,由于Pb²⁺和Ti⁴⁺配位结构的变化,引起Pb²⁺、Ti⁴⁺场强及其与O^2-离子间距的变化,对Li⁺/Na⁺离子交换产生影响,从而改变折射率差值(ΔN)和折射率分布.     

关于（e+e-）,（μ+μ-）原子在库仑场的裂解

本文应用了复合粒子场论的微扰展开理论和自旋为（1/2-1/2）的库仑相互作用原子的Bethe-Salpeter协变波函数的近似解,计算了（e⁺e^-）（μ⁺μ^-）原子的高速飞行下裂解截面及能谱。结果表明（e⁺e^-）原子的裂解截面比前人的计算约小20％。此外,计算还表明（e⁺e^-）及（μ⁺μ^-）原子的单态和三重态裂解截面对任意主量子数n,和极端相对论近似下将精确相等,而前人的计算中只是n=2时才有这一结果,而对n=1时,两者相差约有25％。看来很可能是计算中的错误所致。     

关于产生S态（π+π-）s 原子的直通图

本文求出了梯形近似下（π⁺π^-）_s 态原子的相对论协变的 B-S 波函数,并通过应用这一相对论协变的 B-S 波函数和假设复合场论微扰展开中的最低次项——“直通图”为主,计算了过程π⁺+n→p+（π⁺π^-）_s的截面,讨论了直通图的一些性质.此外,这一计算对如下更有兴趣的过程或许提供了粗略的估计:μ⁺+n→（μ⁺π^-）+p.     

X形色心激光谐振腔参数的确定及类F2+型色心激光运转

文中,针对X形谐振腔的特点及结合纵向泵浦理论,分析了X形谐振腔几何参数的确定条件和模式匹配条件;根据有关NaCl(OH^-):(F₂⁺)_H和KCl(Na⁺,OH^-):(F₂⁺)AH色心激光的主要研究结果,分析了提高色心激光输出效率的可能途径.     

量子色动力学中的e++e-→π+q+q过程

本文利用QCD的渐近自由性质,求出一条腿动量平方固定另一条腿动量平方趋于无穷大时的波函数,并把它应用于计算e⁺+e^-→π+q+（?）过程（其中π介子相对于层子喷注轴有大的横动量）。计算结果表明,这个过程对e⁺+e^-→强子截面的贡献比e⁺+e^-→g+q+（?）过程的贡献小得多。     

在e+e-湮灭中轴子（Axion）的产生及其实验建议

我们计算了在e⁺e^-湮灭中轴子的产生截面,建议利用β⁺放射源在e⁺e^-湮灭实验中寻找轴子。我们还进一步讨论了在这种实验中所用探测器的性能要求。     

D介子衰变Γ（D0→K+K-）/Γ（D0→π+π-）

考虑强作用修正对D⁰介子衰变的影响,用Gilman和Wise^[1]的方法,导出ΔC=1的等效哈密顿量,算得Γ（D⁰→K⁺K^-）/Γ（D⁰→π⁺π^-）～1.26,简单讨论了这种计算方法中的一些问题。     

光生相对论的（μ+μ-）,（e+e-）仲原子

本文应用复合场论微扰展开式和相对论的 B-S 近似波函数,计算了类似于 Primakoff 效应的光生相对论的（e⁺e^-）,（μ⁺μ^-）仲原子的过程.结果与通常点模型的计算结果不同,这里多得出了一个新的形状因子.这表明在通常的Primakoff 效应中也将存在类似的修正.     

NaCl、KCl和NaF晶体高压结构相变点的计算

 通过晶格动力学方法，计算了NaCl、KCl和NaF晶体的NaCl（BⅠ相）结构和CsCl（BⅡ相）结构的Gibbs函数，以及晶体的BⅠ相- BⅡ相变点。计算结果表明，次近邻离子对间存在较强的短程吸引作用，对上述晶体的高压结构相变起关键作用。利用刚离子模型算得的离子势，得到了较为满意的相变点。结果还表明，温度变化对相变点的影响很小。还从Gordon-Kim模型出发，对短程作用势的物理实质作了讨论。     

NaCl的Gruneisen参数及其随压力变化的计算

 本文利用刚性离子模型计算了NaCl的Gruneisen参数及其随压力的变化。计算中，使用了我们以前成功地计算了状态方程的离子势：对最近邻排斥势分别使用了两种形式的修正的Born-Mayer势，并利用电子气理论的计算结果处理了次近邻排斥势和关联势的影响。所得到的结果与实验符合的程度是令人满意的。     

Computer simulation of the structure of liquid cesium and determination of the pair potentials over a wide temperature range

Using diffraction data for liquid cesium structure over a wide temperature range, models of liquid cesium are constructed and the effective pair potentials are extracted using the theory of liquids. The iterative procedure proposed by L. Reatto is used. In the range 323-1923 K the pair potentials are weakly temperature-dependent. The potentials extracted from the diffraction data differ from the potentials calculated using the Animalu-Heine pseudopotential. The self-diffusion coefficients in liquid cesium are determined. Their temperature dependence is described satisfactorily by a power-law function. Zh. éksp. Teor. Fiz. 115, 50–60 (January 1999)     

惰性气体原子间相互作用势比较研究

原子间相互作用势是预测惰性气体输运性质的必要输入条件. 文章对描述惰性气体原子间相互作用的Lennard-Jones势、指数排斥势、Hartree-Fock-Dispersion-B (HFD-B)势和唯象势的形式和特点进行了分析. 基于Chapman-Enskog方法, 计算得到了惰性气体在300–5000 K温度区间内基于四种原子相互作用势的黏性和热导率, 并与文献报道的实验和理论计算结果进行了比较. 研究结果表明, 基于Hartree-Fock排斥理论与色散理论发展起来的HFD-B势能够合理反映惰性气体原子相互作用的趋势与特征, 因而可以较好地预测惰性气体的宏观输运性质.     

MONTE CARLO SIMULATION OF THE ION BEAM ENHANCED DEPOSITION OF SILICON NITRIDE FILMS

In this paper, the growth process of silicon nitride films by ion beam enhanced depo-sition (IBED) is investigated by using the dynamic Monte Carlo simulation, which is based on the binary collision approximation. The effects of the incident angles, energies of the bombarded ions and the interaction potentials on the composition of the films are discussed. The successive and alternate deposition process of silicon and implantation of nitrogen ions have been applied to simulate the actual continuous and synchronous process of IBED. The relationship between the calculated composition of the films and the ion/atom arrival ratio of implanted nitrogen ions to deposited silicon atoms has been established. The composition profile obtained by computer simulation is in good agreement with the experimental results.     

Comparative investigations of the P-V-T relationship of NaCl at high pressure and temperature

Two different potential models of molecular dynamics (MD) simulations have been applied to investigate the pressure-volume-temperature (P-V-T) relationship and lattice parameter of NaCl under high pressure and temperature. The first one is the shell model (SM) potentials in which due to the short-range interaction pairs of ions are moved together as is the case in polarization of a crystal due to the motion of the positive and negative ions, and the second one is the two-body rigid-ion Born-Mayer-Huggins-Fumi-Tosi (BMHFT) potentials with full treatment of long-range Coulomb forces. The P-V relationship at 300 K, T-V relationship at zero pressure, and lattice parameter a, have been obtained and compared with the available experimental data and other theoretical results. Compared with SM potentials, the MD simulation with BMHFT potentials is very successful in reproducing accurately the measured volumes of NaCl. At an extended pressure and temperature ranges, P-V relationship under different isotherms at selected temperatures, T-V relationship under different pressures, and lattice parameter a have also been predicted. The properties of NaCl are summarized in the pressure range 0-30 GPa and the temperature up to 2000 K.     

氯化钠团簇的形成规律与结合能计算

当离子蒸气冷凝形成团簇时，其结构表现出特定的规律。文中对不同大小不同形状的氯化钠团簇结构与结合能进行了计算，以求揭示离子蒸气冷凝形成团簇的一些规律，并与实验结果进行对照。     

High-pressure equation of state for solid krypton from interatomic potentials

The pressure-volume isotherm for krypton at 300 K is evaluated by the Monte Carlo method using pair and three-body potentials. The pair potentials used are that of Aziz and Slaman and a slightly modified version of their potential which gives better agreement with high-energy scattering data. The three-body potentials considered are the Axilrod-Teller interaction and the first-order three-body exchange interaction as parametrized by Loubeyre. The results are compared with recent measurements at pressures up to 300 kbar and the implications of the comparison are discussed. The best agreement with experiment is found using the Axilrod-Teller interaction as the only many-body interaction, indicating that the three-body exchange interaction is to a large extent canceled by higher many-body interactions, at least in the highly symmetrical environment of the crystal.This paper is dedicted to Howard Reiss on the occasion of his 66th birthday.     

Phonon dispersion for the bcc metals Mo and Cr

In this paper the phonon dispersion for the bcc metals Mo and Cr is calculated based on the pair potentials obtained from cohesive energies and the Slater-Kirkwood- type three body interaction. In the calculation of the pair potentials the Möbius transform in the number theory is used and the cohesive energy is evaluated by the LMTO method. The results show a good agreement with inelastic neutron scattering data and indicate that the three-body interaction is necessary to account for the phonon dispersion.