Variational Calculations of Rotational−Vibrational Energies of CH4 and Isotopomers Using an Adjusted ab Initio Potential
Author:
Affiliation:
1. Department of Chemistry and Cherry L. Emerson Center for Scientific Computation, Emory University, Atlanta, Georgia 30322
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp991723b
Reference23 articles.
1. High-Resolution FTIR Spectroscopy Using a Jet: Sampling the Rovibrational Spectrum of12CH4
2. Calculations of the force field of the methane molecule
3. An accurate ab initio quartic force field and vibrational frequencies for CH4 and isotopomers
4. Accurate determination of a potential energy surface for CD3H
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