4.7 Article

New rovibrational kinetic energy operators using polyspherical coordinates for polyatomic molecules

Journal

JOURNAL OF CHEMICAL PHYSICS
Volume 118, Issue 23, Pages 10431-10438

Publisher

AIP Publishing
DOI: 10.1063/1.1574013

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We illustrate how one can easily derive kinetic energy operators for polyatomic molecules using polyspherical coordinates with very general choices for z- axis embeddings and angles used to specify relative orientations of internal vectors. Computer algebra is not required. (C) 2003 American Institute of Physics.

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