Density Functional Study of 59Co Chemical Shielding Tensors Using Gauge-Including Atomic Orbitals
Author:
Affiliation:
1. Department of Chemistry, The Chinese University of Hong Kong, Shatin, New Territories, Hong Kong
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp962200w
Reference48 articles.
1. Calculations of the structures, stabilities, and Raman and zinc NMR spectra of zinc aqua chloride ZnCln(OH2)a2-n species in aqueous solution
2. Ab initio orbital studies of molybdenum-95, oxygen-17, and sulfur-33 chemical shielding in transition-metal compounds
3. Accurate Calculation of NMR Chemical Shifts
4. The Oxidation-State Dependence of Transition-Metal Shieldings
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