首页 | 本学科首页   官方微博 | 高级检索  
     检索      


Systematics of vibrational intensities for “diatomic” molecules: Approximate formulas
Authors:C Chackerian  RH Tipping
Institution:NASA Ames Research Center, Moffett Field, California 94035 USA;Physics Department, University of Nebraska, Omaha, Nebraska 68182 USA
Abstract:Several approximations are discussed which enable one to estimate electric dipole moment transition matrix elements for diatomic molecules based on a very limited amount of experimental data. For strongly polar molecules, a simplistic point-charge dipole model in which there is no vibrational charge flux predicts a simple relation between the permanent moment, M0, and its derivative with respect to internuclear separation, M1. This is found to be approximately valid for a surprisingly large number of polar molecules. Next, approximate matrix elements for the fundamental and overtone bands are presented for a linear dipole moment function. Finally, systematic trends for molecules having similar electronic structures are investigated and combined with the approximations discussed above in order to estimate the transition moments for several molecules of astrophysical interest. An extension to the ν3 fundamental and overtone bands of CH4 is suggestive that some of these ideas may be applicable to certain polyatomic molecules as well.
Keywords:
本文献已被 ScienceDirect 等数据库收录!
设为首页 | 免责声明 | 关于勤云 | 加入收藏

Copyright©北京勤云科技发展有限公司  京ICP备09084417号