首页 | 本学科首页   官方微博 | 高级检索  
     


Average potential energy criterion: Force fields of some planar XY3 and tetrahedral XY4 molecules
Authors:C.P. Girijavallabhan  K. Babu Joseph  S. Sasidharan Nair
Affiliation:Department of Physics, University of Cochin, Cochin 682 022, India
Abstract:Minimization of the average potential energy contributions from bending deformations due to zero point vibration serves as a good criterion for fixing the harmonic force fields in planar XY3 and tetrahedral XY4 nonhydride molecules. An explanation based on the concept of rehybridization of the orbitals of the central atom during a bending vibration is offered.
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