New vibration-rotation code for tetraatomic molecules exhibiting wide-amplitude motion: WAVR4
(2004)
Journal Article
Kozin, I. N., Law, M. M., Tennyson, J., & Hutson, J. M. (2004). New vibration-rotation code for tetraatomic molecules exhibiting wide-amplitude motion: WAVR4. Computer Physics Communications, 163(2), 117-131
A general computational method for the accurate calculation of rotationally and vibrationally excited states of tetraatomic molecules is developed. The resulting program is particularly appropriate for molecules executing wide-amplitude motions and i... Read More about New vibration-rotation code for tetraatomic molecules exhibiting wide-amplitude motion: WAVR4.