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Abstract

An analytical formula has been proposed to predict the high-lying spectral lines of rovibrational transitions for diatomic systems by Sun et al. who used multiple spectral difference method. This study improves the formula based on their previous work by adding a higher order spectral term Hv. Applications of this new formula to the AuO molecule shows that the accuracy of the P-branch rovibrational transition lines is about one order of magnitude better than the results obtained using the previous formula, and that the contributions of the small quantity Hv to the high-lying rovibrational energies and the transitional lines are shown to be important.

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Funds:Project supported by the National Natural Science Foundation of China (Grant Nos. 11074204, 11174236, 11204244), and the Science Foundation of the Chinese Educational Ministry (Grant No. 20100181110085).

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Vol. 62, Issue 21 - 2013-11-05

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