Torsional Angle Definitions and Linear and Quadratic Force Field Variations along the Torsional Coordinate for CH3OH and CH3CHO

Author:

Xu Li-Hong,Hougen Jon T.,Lees Ronald M.,Mekhtiev Mirza A.

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,Spectroscopy,Atomic and Molecular Physics, and Optics

Reference33 articles.

1. Coordinates, Hamiltonian, and Symmetry Operations for the Small-Amplitude Vibrational Problem in Methyl-Top Internal-Rotor Molecules like CH3CHO

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3. GAUSSIAN 98, Revision A.6,1998

4. Certain commercial products are identified in this paper in order to specify adequately the experimental or theoretical procedures. In no case does such identification imply recommendation or endorsement by the National Institute of Standards and Technology, nor does it imply that the products are necessarily the best available for the purpose.

5. Reaction path Hamiltonian for polyatomic molecules

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