Trends in R−X Bond Dissociation Energies (R = Me, Et, <i>i</i>-Pr, <i>t</i>-Bu; X = H, CH<sub>3</sub>, OCH<sub>3</sub>, OH, F): A Surprising Shortcoming of Density Functional Theory
The performance of a variety of high-level composite procedures, as well as lower-cost density functional theory (DFT)- and second-order perturbation theory (MP2)-based methods,...