A program to generate numerical orbital functions
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资源简介：
Title of program: NUMERICAL ORBITAL FUNCTIONS
Catalogue Id: ACQS_v1_0
Nature of problem
The program BASFUN solves the radial Schrodinger equation for any specified central potential and angular momentum, either at a given energy, or subject to a given R-matrix boundary condition. In both cases the solution can be made orthogonal to any number of specified functions. The eigenfunctions which are obtained in numerical form are required: (a) as continuum basis functions in an R-matrix calculation, (b) as Sturmian functions to be used in the calculation of atomic properties such as the ...
Versions of this program held in the CPC repository in Mendeley Data
ACQS_v1_0; NUMERICAL ORBITAL FUNCTIONS; 10.1016/0010-4655(70)90021-4
This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)
创建时间：
2019-12-18
