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Isotropic nuclear shielding constants at the equilibrium molecular structure σeq and zero‐point vibrational corrections (ZPVCs) to σeq are evaluated using the B3LYP/aug‐cc‐pVTZ level of theory, as well as the KT2/aug‐cc‐pVTZ level of theory. Various scaling factors and systematic corrections are obtained by linear regression to experimental shielding constants. Comparisons of the scaled and systematically...
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