We propose 10 desirable features or criteria for general purpose methods to be applied to the calculation of a range of spectroscopic properties. We discuss the second‐order polarization propagator approximation (SOPPA) in light of these criteria by giving the actual computational expression used as well as a few numerical examples taken from the theory of NMR spectra (magnetic shieldings and spin‐spin coupling constants). We demonstrate that SOPPA comes close to fulfilling these criteria.
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Oddershede et al. (1991) studied this question.
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