Potential energy curve of H+2related to mirror-plane ground-state electron density
作者:
N.H. March,
J.A. Alonso,
J.M. López,
期刊:
Molecular Physics
(Taylor Available online 1993)
卷期:
Volume 79,
issue 5
页码: 1143-1146
ISSN:0026-8976
年代: 1993
DOI:10.1080/00268979300101901
出版商: Taylor & Francis Group
数据来源: Taylor
摘要:
For closed shells in a bare Coulomb field, the one-centre densityp(r) can be characterized solely by s states. Here, the two-centre bare Coulomb field is considered for the molecular ion H+2. The potential energy curve, known to be a unique function of the ground-state densityp(rR), withRthe internuclear separation, is shown here to be determined solely by the electron density on the plane perpendicularly bisecting the bond axis.
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