原子轨道杂化理论首先是由Pauling等人提出来的.现行有关文献在介绍杂化理论时,对杂化轨道系数的计算提出过许多方法,有些较嫌繁琐,有必要进行简化.鉴于这种情况,本文试图提出一种计算杂化轨道系数的简化方法.该法仅根据杂化轨道和原子轨道的空间分布,引出了几个简单公式和原则,以确定杂化轨道系数.该法所得结果与文献完全吻合. The theory of atomic orbital hybridization was first proposed by Pauling et al. In the current literature, many methods have been proposed for the calculation of hybrid orbital coefficients, some of which are too cumbersome and need to be simplified. In view of this This article attempts to propose a simplified method for calculating the orbital coefficients of hybrids by introducing several simple formulas and principles based only on the spatial distribution of hybrid orbital and atomic orbitals to determine the hybrid orbital coefficients. And the literature exactly.