EXTENSION OF THE CURVILINEAR INTERNAL COORDINATE FORMULATION OF THE VIBRATION--ROTATION $ENERGIES^{1}$ TO HIGHER ORDER

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1979

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Ohio State University

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The connection between rotation vectors and angular velocity is used to extend the curvilinear internal coordinate formulation of vibration-rotation dynamics to higher orders in the rotation vector ρ=tΣ(I∘−1X)tSt, which is determined by the equilibrium inertial tensor I0, the equilibrium Coriolis coupling matrix X0, and internal coordinates St. Third and higher order terms of the rotated ineritial tensor I and second and higher order terms of the rotated Coriolis coupling matrix X are presented and discussed.

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1C.R. Quade, J. Chem. Phys., vol. 64, 2783 (1976).


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