| HAL CNRS portal |  |
Journal articles
Rigid-Bender Close-Coupling Treatment of the Inelastic Collisions of H$_2$O with Para-H$_2$
Abstract : We present a new method taking explicitly into account the coupling between rotation and bending of a nonlinear triatomic molecule colliding with an atom. This approach based on a rigid-bender treatment of the triatomic molecule was originally developed for the case of triatomic molecule linear at equilibrium. It is here extended to the case of a colliding bent triatomic molecule at equilibrium and applied to the case of the para-H$_2$ + H$_2$O inelastic collision using a new H$_2$O-para-H$_2$ adiabatically reduced 4D potential.
https://hal.archives-ouvertes.fr/hal-02160848
Contributor : Aigle Clementin Connect in order to contact the contributor
Submitted on : Thursday, June 20, 2019 - 9:49:38 AM
Last modification on : Friday, August 5, 2022 - 10:59:38 AM
Contributor : Aigle Clementin Connect in order to contact the contributor
Submitted on : Thursday, June 20, 2019 - 9:49:38 AM
Last modification on : Friday, August 5, 2022 - 10:59:38 AM