Spectrochim Acta A Mol Biomol Spectrosc
April 2024
A room temperature line list for the HO radioactive isotopologue of the water molecule is computed using the variational nuclear-motion DVR3D program suite and an empirical high-precision potential energy function. The line list consists of rotation-vibrational energies and Einstein-A coefficients, covering a wide spectral range from 0 to 25000 cm and the total angular momenta J up to 30. Estimates of air-broadening coefficients are provided.
View Article and Find Full Text PDF