A copy of this work was available on the public web and has been preserved in the Wayback Machine. The capture dates from 2019; you can also visit the original URL.
The file type is application/pdf
.
Water line lists close to experimental accuracy using a spectroscopically determined potential energy surface for H2O16, H2O17, and H2O18
2008
Journal of Chemical Physics
Line lists of vibration-rotation transitions for the H 2 16 O, H 2 17 O, and H 2 18 O isotopologues of the water molecule are calculated, which cover the frequency region of 0 -20 000 cm −1 and with rotational states up to J =20 ͑J = 30 for H 2 16 O͒. These variational calculations are based on a new semitheoretical potential energy surface obtained by morphing a high accuracy ab initio potential using experimental energy levels. This potential reproduces the energy levels with J = 0, 2, and 5
doi:10.1063/1.2927903
pmid:18554012
fatcat:w6pqwjduwncnlma2mzooss6v3m