论文标题

关于电子分子碰撞物理学中的标准方法

About the standard methodology in electron-molecule collision physics

论文作者

Baltenkov, A. S., Woiciechowski, I.

论文摘要

本文讨论了关于分子连续电子功能与电子原子散射中波函数的相似性的假设的正确性。已经研究了通过一对非重叠的短距离电位对缓慢颗粒的弹性散射。粒子的连续波函数表示为平面波和两个球形S波的组合,由散射中心产生。该功能的渐近学决定了封闭形式的弹性颗粒散射的幅度。结果表明,在非球目标上的散射幅度不能正确表示为一系列球形函数的扩展,就像在原子上散射的情况一样。因此,基于基于分子球超出分子势场的球形对称性的假设,散射相计算的方法不能视为合理和可靠。波浪函数的这一领域的表示也是如此,作为Schrödinger方程的常规和不规则溶液的线性组合。已经表明,在距分子远距离的渐近差异可以作为另一组的扩展,而不是球形的正交函数。获得这些功能的一般公式。散射幅度扩展到一系列功能的系数决定了正在考虑的分子系统的散射阶段。讨论了针对任意非球体电势情况的S-Matrix方法的特殊特征。

The article discusses the correctness of the assumption about the similarity of molecular continuum electron functions with wave functions in electron-atom scattering. The elastic scattering of slow particles by pair of non-overlapping short-range potentials has been studied. The continuum wave function of particle is represented as a combination of a plane wave and two spherical s-waves, generated by the scattering centers. The asymptotic of this function determines in closed form the amplitude of elastic particle scattering. It is shown that this amplitude of scattering on a nonspherical target cannot be correctly represented as an expansion into a series of spherical functions , as is the case for scattering on an atom. Therefore, methods of the scattering phase calculation based on the assumption of spherical symmetry of the molecular potential field beyond the molecular sphere cannot be considered as justified and reliable. So is the representation outside this sphere of the wave function as a linear combination of the regular and irregular solutions of the Schrödinger equation. It has been shown that asymptotically at great distances from the molecule the continuum wave functions can be presented as an expansion in a set of other, than spherical, orthonormal functions . General formulas for these functions are obtained. The coefficients of the scattering amplitude expansion to a series of these functions determine the scattering phases for the molecular system under consideration. The special features of the S-matrix method for the case of arbitrary non-spherical potentials are discussed.

扫码加入交流群

加入微信交流群

微信交流群二维码

扫码加入学术交流群,获取更多资源