Title of article :
Transition intensities in rare gas triatomic ions: DIM versus point-charge approximation Original Research Article
Author/Authors :
F.Y. Naumkin، نويسنده ,
Issue Information :
هفته نامه با شماره پیاپی سال 2000
Pages :
14
From page :
301
To page :
314
Abstract :
Diatomics-in-molecule (DIM) approach is compared with the point-charge approximation for transition moments in Rg3+ and is shown to be its extension capable of accurately reproducing the direct ab initio results. Relevant polarization corrections to the point-charge approximation are proposed. The developed procedure is applied to construction of transition moment and intensity (oscillator strength) 3D-surfaces of Ne3+. They are used to evaluate the photoabsorption spectra of the bound species and of the Ne + Ne2+ collisional system. The major absorption band of Ne3+ is predicted to be red-shifted by 200 nm from that for the diatomic ion, and the absorption spectrum of Ne2+ is found to be significantly affected in collisions with Ne.
Journal title :
Chemical Physics
Serial Year :
2000
Journal title :
Chemical Physics
Record number :
1056610
Link To Document :
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