Neutron powder diffraction experiments in the temperature range 300-1770 K were performed at BENSC, Berlin, Germany, on synthetic (Mg0.70Fe0.23) Al1.97O4. The cation partitioning over the crystallographic tetrahedral and octahedral sites was determined as a function of temperature through joint Rietveld refinements and advanced minimization techniques. The thermal expansion coefficients of the lattice parameter and inter-atomic bond lengths were also obtained from the full-profile structure refinements. The behaviour of the polyhedral bond-lengths, especially the T-O distances, and of the cell constant upon heating, clearly indicate that the interdiffusion of tetrahedral and octahedral Mg/Al cations starts at about 950 K. This result is straightforwardly supported by the direct analysis of the neutron site scattering factors: Fe always retains tetrahedral coordination at all temperatures, and the cation rearrangement is entirely due to Mg and Al diffusion.
|Titolo:||Cation partitioning versus temperature in Mg0.70Fe0.23Al1.97O4 synthetic spinels, by in situ neutron powder diffraction|
PAVESE, ALESSANDRO (Primo)
|Parole Chiave:||Neutron powder diffraction; Ordering versus T; Synthetic spinels|
|Settore Scientifico Disciplinare:||Settore GEO/06 - Mineralogia|
|Data di pubblicazione:||feb-1999|
|Digital Object Identifier (DOI):||10.1007/s002690050183|
|Appare nelle tipologie:||01 - Articolo su periodico|