Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5430704 | Journal of Quantitative Spectroscopy and Radiative Transfer | 2008 | 10 Pages |
Abstract
A line list for D2Â 16O isotopologue of water molecule was calculated in the region 0-16,000Â cmâ1 with energy levels up to J=30. Variational calculations are based on the semi-theoretical potential energy surface obtained by morphing ab initio potential using the experimental energy levels of D2Â 16O. For energy levels with J=0, 2, 5 and 10, the standard deviation of the fit is 0.023Â cmâ1. This line list should make an excellent starting point for spectroscopic modeling and analysis of D2O rovibrational spectra.
Related Topics
Physical Sciences and Engineering
Chemistry
Spectroscopy
Authors
Sergei V. Shirin, Nikolay F. Zobov, Oleg L. Polyansky,