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Author:Bartleson, J.

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Edmiston, C.; Jarvie, J.; Bartleson, J., Analyses of the "allowed" inversion barriers of H2O and NH3: Incompleteness of the Woodward-Hoffmann HOMO-LUMO symmetry ideas due to neglect of molecular orbital terms, J. Chem. Phys., 1986, 84, 6907. [all data]