Table 2 Crystalline parameters obtained from Rietveld refinement using SXRD patterns at Room temperature for Zr4Pd2O and Zr4Rh2O.
From: Observation of superconductivity and enhanced upper critical field of η-carbide-type oxide Zr4Pd2O
Compound | Zr4Pd2O | Zr4Rh2O |
|---|---|---|
Space group | Fd \(\stackrel{\mathrm{-}}{3}\) m (No. 227) | |
Z | 16 | |
a (Å) | 12.4617(1) | 12.3977(3) |
V (Å3) | 1935.22(3) | 1905.54(9) |
x (Zr1) | 0.30762(7) | 0.3111(2) |
x (Tr) | 0.28569(5) | 0.2815(1) |
Uiso (Zr1) | 0.0051(2) | 0.0052(5) |
Uiso (Zr2) | 0.0104(4) | 0.017(1) |
Uiso (Tr) | 0.0126(3) | 0.0193(8) |
Uiso (O) | 0.004 (fixed) | 0.004 (fixed) |
Rwp (%) | 8.438 | 16.550 |
