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  A symmetry-based approach to the effective Hamiltonian for symmetric top molecules in degenerate vibronic states
 
 
Title: A symmetry-based approach to the effective Hamiltonian for symmetric top molecules in degenerate vibronic states
Author: Liu, Xianming
Miller, Terry A.
Appeared in: Molecular physics
Paging: Volume 75 (1992) nr. 6 pages 1237-1258
Year: 1992-04-20
Contents: The effective Hamiltonian for a symmetric top molecule in a degenerate vibronic state is obtained. Included in this Hamiltonian are the rotational, spin-rotational, spin-orbit coupling and electronic spin-spin interactions. The terms of the Hamiltonian are expressed as the product of molecular 'constants,' rotational angular momentum operators, and symmetry operators. A formalism is derived, and tables included, to determine whether or not a symmetry operator vanishes for a given vibronic state of a particular molecular symmetry. In this way, one can easily obtain all the non-vanishing Hamiltonian terms for a particular application.
Publisher: Taylor & Francis
Source file: Elektronische Wetenschappelijke Tijdschriften
 
 

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