The A 6Σ+-X 6Σ+ transition of CrH, Einstein coefficients, and an improved description of the A state
- 10 July 2001
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 115 (3) , 1312-1318
- https://doi.org/10.1063/1.1377892
Abstract
The spectrum of CrH has been reinvestigated in the region using the Fourier transform spectrometer of the National Solar Observatory. The 1-0 and 1-1 bands of the transition have been measured and improved spectroscopic constants have been determined. A value for the 2-0 band origin has been obtained from the band head using estimated spectroscopic constants. These data provide a set of much improved equilibrium vibrational and rotational constants for the state. An accurate description of the transition has been obtained using a multireference configuration interaction approach. The inclusion of both scalar relativity and Cr correlation are required to obtain a good description of both states. The ab initio computed Einstein coefficients and radiative lifetimes are reported.
Keywords
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