EXTENDED THOMAS-FERMI APPROACH TO DIATOMIC SYSTEMS

被引:4
作者
DREIZLER, RM
GROSS, EKU
TOEPFER, A
机构
[1] Institut für Theoretische Physik der Universität, Frankfurt/Main
关键词
D O I
10.1016/0375-9601(79)90874-0
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
An accurate, analytical approximation to the solution of the TFDW equation for two-centre boundary conditions is presented. Correlation diagrams can then be calculated with an effective single-particle potential derived from the TFDW density. Total energies and orbital energies for the N-N system are compared with corresponding HF results. © 1979.
引用
收藏
页码:49 / 53
页数:5
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