类氢原子波函数:初步草图

J. Autschbach
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引用次数: 0

摘要

本章重申了原子轨道的量子数,这些量子数是从一般化学中已知的,并将它们置于迄今为止所发展的背景中。简述了氢原子类氢系统(一个电子加一个带Z电荷的原子核)的薛定谔方程(SE)是如何建立的。当原子核被看作是一个固定的点电荷时,SE只针对电子。SE的解可以通过切换到球极坐标得到,这样变量就可以通过电子到原子核的距离、r和两个角度来分离。电子的动能有一个径向分量,和一个角向分量。后者与角动量量子数有关,它由字母s、p、d、f等组成。后面的第19章提供了SE的一步一步的解决方案。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Hydrogen-like Atomic Wavefunctions: A First Sketch
This chapter reiterates the quantum numbers for atomic orbitals, known from general chemistry, and places them into the context developed so far. It is sketched how the Schrodinger equation (SE) for the hydrogen atom hydrogen-like systems (one electron plus a nucleus of charge Z) is set up. When the nucleus is treated as a fixed point charge, the SE is only for the electron. The solutions of the SE can be obtained by switching to spherical polar coordinates, such that the variables are separable in terms of the electron distance from the nucleus, r, and two angles. The kinetic energy of the electron then has a radial component, and an angular component. The latter is associated with the angular momentum quantum number, which is codified by the letters s, p, d, f, and so forth. A step by step solution of the SE is provided later, in chapter 19.
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