Computing rovibrational levels of polyatomic molecules with polyspherical coordinates and a contracted basis built with a K-independent vibrational primitive basis-Reference-Cited by-同舟云学术

Computing rovibrational levels of polyatomic molecules with polyspherical coordinates and a contracted basis built with a K-independent vibrational primitive basis

Published:2013-07-11 Issue:14-15 Volume:111 Page:2320-2333
ISSN:0026-8976
Container-title:Molecular Physics
language:en
Short-container-title:Molecular Physics

Author:

Wang Xiao-Gang¹,Carrington Tucker¹

Affiliation:

1. Chemistry Department, Queen’s University , Kingston, Ontario, Canada

Publisher

Informa UK Limited

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Molecular Biology,Biophysics

Link

https://www.tandfonline.com/doi/pdf/10.1080/00268976.2013.808387

Reference54 articles.

1. Exact and constrained kinetic energy operators for polyatomic molecules: The polyspherical approach

2. The calculation of the vibration-rotation energies of triatomic molecules using scattering coordinates

3. Quantum dynamics of the van der Waals molecule (N2)2: Anab initiotreatment

4. From Intermolecular Potentials to the Spectra of van der Waals Molecules, and Vice Versa

5. Fully coupled 6D calculations of the ammonia vibration-inversion-tunneling states with a split Hamiltonian pseudospectral approach

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