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

Table 7.2 · Thesis 2 · Faik 2009

Table 7.2 · Thesis 2 · Faik 2009

status thesis-only · visibility public · id tbl:thesis-02.7.2

Crystal structure data and refinement results for \mathrm{Sr}_{2} \mathrm{Mn}^{3+} \mathrm{WO}_{6+\delta} at room temperature. The atomic positions (in fractional coordinates) and temperature factors were refined in the space group I 4 / m. (Note: a=5.6353(1) \AA; c=8.0149(1) \AA and V=254.53(1)^{3}; R_{\mathrm{p}}=10.6 \%; R_{\mathrm{wp}}=15.1 \%; R_{\text {exp }}=5.42 \%; \chi^{2}=7.73).

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Thesis 2 · Faik 2009
Table
7.2
Atom Site x y z \mathrm{~B}\left(\AA^{2}\right)
W 2 a 0 0 0 0.33(7)
Mn 2 b 0 0 1 / 2 0.37(2)
Sr 4 d 0 1 / 2 1 / 4 0.74(3)
O 1 4 e 0 0 0.241(2) 1.05(4)
O 2 8 h 0.219(2) 0.276(1) 0 1.05(4)

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