Chemical-Shift Tensors of Heavy Nuclei in Network Solids: A DFT/ZORA Investigation of 207Pb Chemical-Shift Tensors Using the Bond-Valence Method.

Phys. Chem. Chem. Phys., 2015, Accepted Manuscript
DOI: 10.1039/C5CP03348A, Paper

Fahri Alkan, Cecil Dybowski
Cluster models are used in calculation of ²⁰⁷Pb NMR magnetic-shielding parameters of [small alpha]-PbO, [small beta]-PbO, Pb₃O₄, Pb₂SnO₄, PbF₂, PbCl₂, PbBr₂, PbClOH, PbBrOH, PbIOH, PbSiO₃, and Pb₃(PO₄)₂. We examine the effects of...
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