Title of article
Point group symmetries of the molecular orbitals of HD+ beyond the Born–Oppenheimer approximation
Author/Authors
Gonçalves، نويسنده , , Cristina P and Mohallem، نويسنده , , José R، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2003
Pages
4
From page
533
To page
536
Abstract
The isotope shifts of the electronic states of HD+ are calculated, for the first time, within an adiabatic MO-LCAO theory. A typical heteronuclear C∞v correlation diagram comes out, obeying conservation of point group orbital symmetries and noncrossing rule.
Journal title
Chemical Physics Letters
Serial Year
2003
Journal title
Chemical Physics Letters
Record number
1782597
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