Author(s):
Varandas, A. J. C. 
; Rodrigues, S. P. J. ; Gomes, P. A. J.
Date: 1998
Persistent ID: http://hdl.handle.net/10316/5274
Origin: Estudo Geral - Universidade de Coimbra
Document details
Energy switching potential energy surfaces and spectra of the van der Waals mod...
Description
We report fully six-dimensional potential surfaces for ArHCN by using the energy switching method. They are valid for all energy regimes and hence suitable for studying the dynamics of a wealth of processes, ranging from the dissociative reaction Ar+HCN --> Ar+H+CN to the rovibrational spectroscopy of the ArHCN van der Waals molecule. Calculations of rovibrational energies with J=0 through J=6 arising from j=0 to j=1 levels of HCN are also presented. http://www.sciencedirect.com/science/article/B6TFN-3VCVS9V-G/1/2fee7428d70955a4bf27a49331b15447
We report fully six-dimensional potential surfaces for ArHCN by using the energy switching method. They are valid for all energy regimes and hence suitable for studying the dynamics of a wealth of processes, ranging from the dissociative reaction Ar+HCN --> Ar+H+CN to the rovibrational spectroscopy of the ArHCN van der Waals molecule. Calculations of rovibrational energies with J=0 through J=6 arising from j=0 to j=1 levels of HCN are also presented. http://www.sciencedirect.com/science/article/B6TFN-3VCVS9V-G/1/2fee7428d70955a4bf27a49331b15447
Document Type
Article
Language English
Language English
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