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Sturmians and Generalized Sturmians in Quantum Theory

机译:量子理论中的Sturmians和广义Sturmians

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摘要

The theory of Sturmians and generalized Sturmians is reviewed. It is shown that when generalized Sturmians are used as basis functions, calculations on the spectra and physical properties of few-electron atoms can be performed with great ease and good accuracy. The use of many-center Coulomb Sturmians as basis functions in calculations on N-electron molecules is also discussed. Basis sets of this type are shown to have many advantages over other types of ETO's, especially the property of automatic scaling.
机译:Sturmians和广义Sturmians的理论进行了回顾。结果表明,将广义Sturmian用作基本函数时,可以非常轻松,准确地计算少数电子原子的光谱和物理性质。还讨论了在N电子分子的计算中使用多中心库仑Sturmians作为基函数。与其他类型的ETO相比,这种类型的基础集具有许多优点,尤其是自动缩放的属性。

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