Abstract
Ab initio LCAO-MO SCF wavefunctions have been generated for the oxonium ion using a basis set of STO's. Bond lengths of (1.7, 1.75, 1.8, 1.85, 1.9) bohr and bond angles of (100°, 109°28′, 117°, 120°) have been studied. Deuteron and oxygen quadrupole coupling constants have been calculated.
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