PERIODIC-ORBITS OF THE HYDROGEN MOLECULAR ION AND THEIR QUANTIZATION

Citation
Yw. Duan et al., PERIODIC-ORBITS OF THE HYDROGEN MOLECULAR ION AND THEIR QUANTIZATION, Physical review. A, 52(5), 1995, pp. 3497-3502
Citations number
20
Categorie Soggetti
Physics
Journal title
ISSN journal
10502947
Volume
52
Issue
5
Year of publication
1995
Pages
3497 - 3502
Database
ISI
SICI code
1050-2947(1995)52:5<3497:POTHMI>2.0.ZU;2-S
Abstract
In a classical study of the hydrogen molecular ion beyond the Born-Opp enheimer approximation (BOA), we have found that segments of trajector ies resemble that of the Born-Oppenheimer approximation periodic orbit s; The importance of this fact to the classical understanding of chemi cal bonding leads us to a systematic study of the periodic orbits of t he planar hydrogen molecular ion within the BOA. Besides introducing a classification scheme for periodic orbits, we discuss the convergence properties of families of periodic orbits and their bifurcation patte rns according to their types. Semiclassical calculations of the densit y of states based on these periodic orbits yield results in agreement with the exact quantum eigenvalues of the hydrogen molecular ion syste m.