Abstract
The effects of electronic angular momentum in triatomic linear molecules are considered. An effective vibronic hamiltonian is derived and second order energy level expressions are obtained for the bending levels in an electronic Π state. The formulae allow for the anharmonicity of the bending potentials and for the variation of the expectation value <Lz > with bond angle; effects of electron spins are also included. The vibronic levels predicted by the analytic expressions are compared with those calculated using a full matrix treatment of the orbital angular momentum; it is shown that they are far more accurate than the levels predicted by the formulae currently available in the literature. The relationship between the anharmonic corrections and the deviation of <Lz > from unity is discussed in terms of an electrostatic interaction between linear molecule states of different symmetry.
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.