1989
DOI: 10.1088/0305-4470/22/1/011
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Three-dimensional rotational averages in radiation-molecule interactions: an irreducible cartesian tensor formulation

Abstract: Abstract. In this paper we present a new method for the calculation of the rotational averages which arise in the theory of spectroscopic radiation-molecule interactions in fluid media. Based upon the principles of irreducible Cartesian tensor analysis, the method presented allows us to express results either in the usual reducible form, or directly in terms of linearly independent sets of irreducible tensor products. For interactions up to and including rank 3 in the molecular response (or non-linear suscepti… Show more

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Cited by 33 publications
(27 citation statements)
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“…The selection rules procedure we have employed follows a pattern established previously on nonlinear optical processes, for example Refs. [12][13][14][15][16][17][18], and considers the irreducible Cartesian tensor components of the polarization and molecular response tensors [11]. An irreducible Cartesian basis affords direct connectivity with the directional properties of the radiation and of the electronic transitions, while also affording a transparent linkage with the symmetry-based irreducible representations of the molecular electronic states, using the rules of angular momentum coupling.…”
Section: Discussionmentioning
confidence: 99%
“…The selection rules procedure we have employed follows a pattern established previously on nonlinear optical processes, for example Refs. [12][13][14][15][16][17][18], and considers the irreducible Cartesian tensor components of the polarization and molecular response tensors [11]. An irreducible Cartesian basis affords direct connectivity with the directional properties of the radiation and of the electronic transitions, while also affording a transparent linkage with the symmetry-based irreducible representations of the molecular electronic states, using the rules of angular momentum coupling.…”
Section: Discussionmentioning
confidence: 99%
“…The matrices Y 2m | Q r 2 |Y 00 can then easily be computed by integration over the solid angle. Finally, as the atom is randomly oriented, the transition rate is averaged over the orientation [14,15]. Note that for fixed atom alignment, the transition rate will depend on the magnetic quantum number m of the final state [12].…”
Section: Methodsmentioning
confidence: 99%
“…[16][17][18][19][20][21][22][23][24]. The starting point is a consideration of the irreducible Cartesian tensor components of the polarization and molecular response tensors [13].…”
Section: Symmetry-based Selection Rulesmentioning
confidence: 99%