Pb-207 NMR, powder diffraction, and Monte Carlo studies of PbxM1-x(NO3)(2)solid solutions

Citation
Ys. Kye et al., Pb-207 NMR, powder diffraction, and Monte Carlo studies of PbxM1-x(NO3)(2)solid solutions, J PHYS CH B, 105(25), 2001, pp. 5892-5899
Citations number
25
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF PHYSICAL CHEMISTRY B
ISSN journal
15206106 → ACNP
Volume
105
Issue
25
Year of publication
2001
Pages
5892 - 5899
Database
ISI
SICI code
1520-6106(20010628)105:25<5892:PNPDAM>2.0.ZU;2-F
Abstract
The solid solutions [Pb,Sr](NO3)(2) and [Pb,Ba](NO3)(2) show a multiplicity of Pb-207 NMR signals, arising from shifts of the Pb-207 resonances by les s polarizable neighbors. The shifts have a unique anisotropic signature tha t allows tentative assignment of some of the signals. Monte Carlo simulatio n of the spectral intensities shows that the ions are slightly clustered in the crystal, which disagrees with:a conventional but specious analysis of the dependence of the unit cell volume on composition. The extent of the cl ustering is attributable to the differences between the van der Waals inter action energies of the ions.