VIBRATION-ROTATION HAMILTONIANS AND THE RENNER-TELLER EFFECT
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Date
1984
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Ohio State University
Abstract
A variational method for the determination of vibronic energy levels of Renner-Teller triatomic molecules is introduced. The form of the hamiltonian and the expansion functions will be discussed. Applications to $CH_{2}{^{+}}$ and $NH_{2}$ will be presented, which include a full treatment of bend-stretch interactions and anharmonic effects. The form of vibrational hamiltonians in internal coordinates is discussed.
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Author Institution: University Chemical Laboratory