DENSITY FUNCTIONALS FOR THE YUKAWA ELECTRON-ELECTRON INTERACTION

被引：265

作者：

SAVIN, A ^{[1
]}

FLAD, HJ ^{[1
]}

机构：

[1] UNIV STUTTGART, INST THEORET CHEM, D-70569 STUTTGART, GERMANY

来源：

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | 1995年 / 56卷 / 04期

关键词：

D O I：

10.1002/qua.560560417

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

Short-range nonclassical electron-electron interaction is described by a density functional in a scheme that allows multideterminant wave functions. The parameter that determines the coupling with the configuration-interaction-type calculations can be chosen in a controlled manner. Results are presented for the He and the Be series using a Yukawa-type interaction. (C) 1995 John Wiley & Sons, Inc.

引用

页码：327 / 332

页数：6

共 35 条

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