The A 6Σ+-X 6Σ+ transition of CrH, Einstein coefficients, and an improved description of the A state

Abstract
The spectrum of CrH has been reinvestigated in the 9000–15 000 cm−1 region using the Fourier transform spectrometer of the National Solar Observatory. The 1-0 and 1-1 bands of the A 6Σ+-X 6Σ+ 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 A 6Σ+ state. An accurate description of the A-X transition has been obtained using a multireference configuration interaction approach. The inclusion of both scalar relativity and Cr 3s3p correlation are required to obtain a good description of both states. The ab initio computed Einstein coefficients and radiative lifetimes are reported.