Abstract

Coupled Hartree-Fock calculations in various basis sets yield values in the range 6.7 to 6.8 for the Sternheimer antishielding factor (1 − γ ∞) of the nitrogen nucleus in the ammonium ion. These are in substantial agreement with the value of 9 that is obtained from a model of measured relaxation times in solid ammonium chloride when allowance is made for effects of the crystalline environment on the chloride ion Sternheimer antishielding factor. Other experimental estimates of the nitrogen Sternheimer factor are discussed. The new value is used to derive cation field gradients from measured quadrupole coupling constants in solid NH 4ReO 4 and NH 4IO 4.

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