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Title: Order-disorder transition in Sr/sub 2/IrD/sub 5/: evidence for square pyramidal IrD/sub 5/ units from powder neutron diffraction data

Journal Article · · J. Solid State Chem.; (United States)

Neutron diffraction data have been collected on a powdered sample of Sr/sub 2/IrD/sub 6/ over a range of temperatures. The compound, which is cubic at room temperature, has been found to exhibit a gradual transformation to a tetragonal phase in the temperature range 200 to 140 K. As a result of the transition, deuterium atoms which randomly occupy sixfold positions in the cubic phase, become tetragonally ordered. A small fraction of the cubic phase remained untransformed at 4.2 K. Both the cubic and tetragonal structures are consistent with square pyramidal IrD/sub 5/ units with average Ir-D distances of 1.714 and 1.718 A, respectively. Agreement factors, R/sub 1/, for the two structural analyses are 3.44 and 4.94%.

OSTI ID:
5554332
Journal Information:
J. Solid State Chem.; (United States), Vol. 40:3
Country of Publication:
United States
Language:
English