Analysis of quantum mechanics applications for NMR spectroscopy using chloroform as a solvent.
Chloroform, often in the deuterated form CDCl3, is a very common solvent for NMR and other types of spectroscopy. Quantum mechanics is increasingly used to calculate such spectra to aid assignment and the solvent is here normally simulated as a continuum rather than by explicit inclusion of one or more chloroform molecules.
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Henry S. Rzepa (2016) studied this question.
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