High resolution rotational analysis of the B 3Π–X 3Δ (1,0) band of titanium monoxide

作者: Claude Amiot , El Mehdi Azaroual , Paul Luc , Raymond Vetter

DOI: 10.1063/1.469486

关键词: MonoxideHamiltonian (quantum mechanics)Tunable laserSpectroscopyAb initio quantum chemistry methodsQuantum numberTitaniumMoleculeChemistryAnalytical chemistryAtomic physics

摘要: The B 3Π–X 3Δ (1,0) band of titanium monoxide has been studied at sub‐Doppler resolution (0.002 cm−1) by crossing a beam TiO molecules with cw tunable laser and collecting the laser‐induced fluorescence. rotational structure 42 branches belonging to 3Π–3Δ transition analyzed up quantum numbers equal 94. Spectroscopic data have reduced set 24 molecular constants, using case (a) effective Hamiltonian. rotational, spin–orbit Λ‐doubling constants are discussed in terms leading configurations which give rise X 3Δ B 3Π electronic states. It is shown that for B state, existing ab initio calculations not able reproduce second order effect Λ doubling effect.

参考文章(14)
Robert W. Field, Hélène Lefebvre-Brion, Perturbations in the Spectra of Diatomic Molecules ,(2012)
William H. Hocking, M. C. L. Gerry, A. J. Merer, Rotational analysis of four bands of the γ′(B3Π–X3Δ) system of TiO Canadian Journal of Physics. ,vol. 57, pp. 54- 68 ,(1979) , 10.1139/P79-006
R.N. Zare, A.L. Schmeltekopf, W.J. Harrop, D.L. Albritton, A Direct Approach for the Reduction of Diatomic Spectra to Molecular Constants for the Construction of RKR Potentials Journal of Molecular Spectroscopy. ,vol. 46, pp. 37- 66 ,(1973) , 10.1016/0022-2852(73)90025-8
John G. Phillips, Sumner P. Davis, TIO MOLECULAR EMISSION IN THE SPECTRUM OF VY CANIS MAJORIS. Publications of the Astronomical Society of the Pacific. ,vol. 99, pp. 839- 841 ,(1987) , 10.1086/132045
J.M. Brown, M. Kaise, C.M.L. Kerr, D.J. Milton, A determination of fundamental Zeeman parameters for the OH radical Molecular Physics. ,vol. 36, pp. 553- 582 ,(1978) , 10.1080/00268977800101761
Walter J. Balfour, Anthony J. Merer, Hideaki Niki, Benoit Simard, Peter A. Hackett, Rotational, fine, and hyperfine analyses of the (0,0) band of the D 3Π–X 3Δ system of vanadium mononitride Journal of Chemical Physics. ,vol. 99, pp. 3288- 3303 ,(1993) , 10.1063/1.465138
Paul S. Bagus, Constance J. Nelin, Charles W. Bauschlicher, On the nature of the low-lying states of TiO Chemical Physics Letters. ,vol. 101, pp. 229- 234 ,(1983) , 10.1016/0009-2614(83)87003-1
N. M. White, R. F. Wing, Photoelectric two-dimensional spectral classification of M supergiants. The Astrophysical Journal. ,vol. 222, pp. 209- 219 ,(1978) , 10.1086/156136
J. W. T. Spinks, Gerhard Herzberg, Molecular Spectra and Molecular Structure ,(1992)
Paul W. Merrill, Armin J. Deutsch, Philip C. Keenan, Absorption Spectra of M-Type Mira Variables. The Astrophysical Journal. ,vol. 136, pp. 21- ,(1962) , 10.1086/147348