Four-parameter analytical local model potential for atoms

被引:0
|
作者
余飞 [1 ,2 ]
孙久勋 [1 ]
田荣刚 [1 ]
杨维 [1 ]
机构
[1] Department of Applied Physics, University of Electronic Science and Technology
[2] College of Physics and Electronic Information, China West Normal University
基金
中国国家自然科学基金;
关键词
analytical local potential; atomic structure;
D O I
暂无
中图分类号
O562.4 [原子间的作用、激发与电离];
学科分类号
070203 ; 1406 ;
摘要
Analytical local model potential for modeling the interaction in an atom reduces the computational effort in electronic structure calculations significantly. A new four-parameter analytical local model potential is proposed for atoms Li through Lr, and the values of four parameters are shell-independent and obtained by fitting the results of Xa method. At the same time, the energy eigenvalues, the radial wave functions and the total energies of electrons are obtained by solving the radial Schrdinger equation with a new form of potential function by Numerov’s numerical method. The results show that our new form of potential function is suitable for high, medium and low Z atoms. A comparison among the new potential function and other analytical potential functions shows the greater flexibility and greater accuracy of the present new potential function.
引用
收藏
页码:4234 / 4241
页数:8
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