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Activation Energies of Pericyclic Reactions: Performance of DFT, MP2, and CBS-QB3 Methods for the Prediction of Activation Barriers and Reaction Energetics of 1,3-Dipolar Cycloadditions, and Revised Activation Enthalpies for a Standard Set of Hydrocarbon Pericyclic Reactions
Ess, Daniel H., Houk, K. N.Volume:
109
Year:
2005
Language:
english
Pages:
12
DOI:
10.1021/jp052504v
File:
PDF, 518 KB
english, 2005