15min:
NUCLEAR HYPERFINE STRUCTURE IN THE X3 Sigma+ STATE OF 91ZrC.

S. J. RIXON, Department of Physics and Astronomy, University of British Columbia, 6224 Agricultural Road, Vancouver, B.C. V6T 1Z1, Canada; P. K. CHOWDHURY AND A. J. MERER, Department of Chemistry, University of British Columbia, 2036 Main Mall, Vancouver, B.C. V6T 1Z1, Canada.

Electronic bands of zirconium monocarbide, ZrC, can be observed following the reaction of laser-ablated Zr atoms with methane under supersonic free-jet conditions. In our experiments some of the bands near 17000 cm-1 are strong enough for nuclear hyperfine structure from the 91Zr isotope (I = 5/2, 11.22% abundance) to be assignable. Hyperfine splittings of up to 0.2 cm-1 are found in some of the rotational lines. Analysis shows that the principal hyperfine effects are in the 3 Sigma ground state, where b = -0.03132 \pm 0.00015 cm-1 and c = - 0.00122 \pm 0.00038 cm-1 (3 sigma error limits). The large Fermi contact parameter, b, indicates that an unpaired Zr 5s sigma electron is present, which, taken together with the small value of lambda (0.5139 cm-1), means that the ground state must be a 3 Sigma+ state, from the electron configuration (Zr 5s sigma)1 (C 2p sigma)1. Internal hyperfine perturbations occur between the F1 and F3 electron spin components of the ground state in the range N = 2 - 4, producing extra lines in some of the branches; the perturbations are of the type Delta N = 0, Delta J = \pm 2, and are a second order effect arising because the F1 and F3 spin components (J = N + 1 and J = N - 1, respectively) both interact with the F2 component (J = N) through Delta N = 0, Delta J = \pm 1 matrix elements of the Fermi contact operator.