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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Application of the Effective Operator Approach to the Calculation of 12C16O2 Line Intensities

Teffo1, Lyulin, Perevalov

  • 1CNRS, Universite Pierre et Marie Curie, 4 Place Jussieu, Paris Cedex 05, 75252, France

Journal of Molecular Spectroscopy
|February 25, 1998
PubMed

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Spin systems where the difference in chemical shifts of the coupled nuclei is greater than ten times J are called first-order spin systems. These nuclei are weakly coupled, and their chemical shifts and coupling constant can generally be estimated from the well-separated signals in the spectrum.
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