1987•The Journal of Chemical PhysicsRequires access

Applications of the generator coordinate approximation to diatomic systems. II. Dunham analysis of vibration–rotation spectra

Luc Lathouwers, Piet Van Leuven, Erik Deumens, Yngve Öhrn

Open publisher page 7 citations

Abstract

It is shown how a Dunham series can be derived within the generator coordinate approximation. General kernel expansions are combined with order by order angular momentum projection and generator coordinate perturbation theory. The comparison of Born–Oppenheimer and generator coordinate kernal coefficients yields a clear identification of nonadiabatic effects incorporated in the generator coordinate approximation.

About this research paper

What this paper is about

It is shown how a Dunham series can be derived within the generator coordinate approximation. General kernel expansions are combined with order by order angular momentum projection and generator coordinate perturbation theory. The comparison of Born–Oppenheimer and generator coordinate kernal coefficients yields a clear identification of nonadiabatic effects incorporated in the generator coordinate approximation.

Why it matters

OpenAlex reports 7 citations for this work. Citation counts describe recorded attention and do not establish research quality.

Key contribution

A contribution statement is not available in the OpenAlex record.

Method / approach

Method details are not available in the OpenAlex metadata.

Main findings

Findings are not separately available in the OpenAlex metadata.

Limitations

Limitations are not available in the OpenAlex metadata.

Applications

Application details are not available in the OpenAlex metadata.

Available abstract

It is shown how a Dunham series can be derived within the generator coordinate approximation. General kernel expansions are combined with order by order angular momentum projection and generator coordinate perturbation theory. The comparison of Born–Oppenheimer and generator coordinate kernal coefficients yields a clear identification of nonadiabatic effects incorporated in the generator coordinate approximation.

Key concepts: Coordinate system, Generator (circuit theory), Diatomic molecule, Physics, Angular momentum, Rotation (mathematics), Cartesian coordinate system, Perturbation theory (quantum mechanics)

Related papers

Back to paper searchBrowse research topicsOriginal source
Applications of the generator coordinate approximation to diatomic systems. II. Dunham analysis of vibration–rotation spectra — Research Paper | ScholarLens