RELATIVISTIC EFFECTS IN BONDING AND DIPOLE-MOMENTS FOR THE DIATOMIC HYDRIDES OF THE 6TH-ROW HEAVY-ELEMENTS - COMMENT

被引：5

作者：

BALASUBRAMANIAN, K

CHRISTIANSEN, PA

PITZER, KS

机构：

[1] CLARKSON UNIV, DEPT CHEM, POTSDAM, NY 13676 USA

[2] UNIV CALIF BERKELEY, DEPT CHEM, BERKELEY, CA 94720 USA

来源：

PHYSICAL REVIEW A | 1991年 / 43卷 / 05期

关键词：

D O I：

10.1103/PhysRevA.43.2581

中图分类号：

O43 [光学];

学科分类号：

070207 ; 0803 ;

摘要：

We compare the recent results of Ramos, Pyper, and Malli [Phys. Rev. A 38, 2729 (1988)] on sixth-row hydrides with our previous results and experiment. It is shown that the four-component Dirac-Fock method yields poor D(e)'s and an unrealistic description of bonding compared to previous calculations and experiment.

引用

页码：2581 / 2582

页数：2

共 5 条

[1] RELATIVISTIC CONFIGURATION-INTERACTION CALCULATIONS OF THE LOW-LYING STATES OF BIH [J].