Predissociation of HCN/DCN in Two Lowest-Lying Singlet Excited States: Effect of Fermi Resonances on Spectra and Dynamics-Reference-Cited by-同舟云学术

Predissociation of HCN/DCN in Two Lowest-Lying Singlet Excited States: Effect of Fermi Resonances on Spectra and Dynamics

Published:2002-10-01 Issue:43 Volume:106 Page:10174-10183
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Xu Dingguo¹,Xie Daiqian¹,Guo Hua¹

Affiliation:

1. Department of Chemistry, University of New Mexico, Albuquerque, New Mexico 87131, Department of Chemistry, Sichuan University, Chengdu, Sichuan, P. R. China, and Institute of Theoretical and Computational Chemistry, Department of Chemistry, Nanjing University, Nanjing 210093, P. R. China

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp021442v

Reference48 articles.

1. ULTRAVIOLET ABSORPTION SPECTRA OF HCN AND DCN: I. THE α—X AND β—X SYSTEMS

2. Geometries of the excited electronic states of HCN

3. SCF CI calculations on HCN excited states

4. SCF CI calculation on HCN: HCN dissociation curves

5. Abinitio calculation of the vibrational structure in the electronic spectra of HCN and DCN between 1700 and 2000 Å

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