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From
An Undergraduate Computational Chemistry Experiment: Investigation of the E2 Elimination Reaction of 2-Bromopropane to Propene
Monsurat M. Lawal, Tugba G Kucukkal
World Journal of Chemical Education
.
2024
, 12(1), 13-18 doi:10.12691/wjce-12-1-3
Table 1. Reactant energies (in Hartree) at different levels of theory
Full size table and legend
Table 2. Product energies (in Hartree) at different levels of theory
Full size table and legend