As density functional theory becomes a serious method for computational chemists, it is important to understand how elementary problems are treated. We examine the potential-energy curves for the dissociation of the hydrogen and nitrogen molecules.
A. M. Lee and N. C. Handy, J. Chem. Soc., Faraday Trans., 1993, 89, 3999 DOI: 10.1039/FT9938903999
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