perovskite atlas Structures, modes and phase transitions · Josu M. Igartua · UPV/EHU

Table 2 · Gateshki et al. 2003

Table 2 · Gateshki et al. 2003

status published · visibility public · id tbl:10.1088-0953-8984-15-36-309.2

Crystal structure data and refinement results for \mathrm{Sr}_{2} \mathrm{MWO}_{6}(\mathrm{M}=\mathrm{Ni}, \mathrm{Zn}, \mathrm{Co}, \mathrm{Cu}). The atomic positions were refined in the space group I 4 / m. (The five atoms in the asymmetric unit occupy the following sites: W 2a ( 0,0,0); Ni, Zn, Co or Cu 2b ( 0,0,1 / 2); Sr 4c ( 0,1 / 2,1 / 4); O1 8h (x, y, 0) and O2 4e (0,0, z).)

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Gateshki et al. 2003
Table
2
\mathrm{Sr}_{2} \mathrm{NiWO}_{6} \mathrm{Sr}_{2} \mathrm{ZnWO}_{6}^{\mathrm{a}} \mathrm{Sr}_{2} \mathrm{CoWO}_{6} \mathrm{Sr}_{2} \mathrm{CuWO}_{6}
a (Å) 5.5608(1) 5.5973(2) 5.5820(1) 5.4291(1)
c (Å) 7.9191(1) 7.9889(3) 7.9774(1) 8.4154(1)
O1 (x) 0.209(2) 0.202(2) 0.201(1) 0.202(1)
O1 (y) 0.280(2) 0.292(2) 0.274(1) 0.298(1)
O2 (z) 0.244(1) 0.241(2) 0.238(1) 0.224(1)
R_{\mathrm{p}}(\%) 8.58 9.72 11.8 15.3
R_{\mathrm{wp}} (%) 10.2 12.1 16.3 15.9
R_{\text {exp }} (%) 4.96 5.37 7.63 8.57
\chi^{2} 4.23 5.08 4.26 3.45

Evidence