PROTON MAGNETIC SHIELDING IN MOLECULES
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Date
1958
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Publisher
Ohio State University
Abstract
“A simplified method is described for calculation of proton shielding in molecules, in which molecular wave functions are constructed from gauge invariant atomic orbitals. The method is applied to the hydrogen molecule in simple LCAO MO description, and the total nuclear shielding constant is computed to be $3.2 \times 10^{-5}$ Applications of the method to the hydrogen halides are discussed.”
Description
Author Institution: Department of Chemistry, Carnegie Institute of Technology