Table 1 · Iturbe‐Zabalo et al. 2012
status published · visibility public · id tbl:10.1016-j.molstruc.2012.08.049.1
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Iturbe‐Zabalo et al. 2012
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Table
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1
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\mathrm{CaPr}_{2} \mathrm{CuTi}_{2} \mathrm{O}_{9} |
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\mathrm{CaNd}_{2} \mathrm{CuTi}_{2} \mathrm{O}_{9} |
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\mathrm{CaSm}_{2} \mathrm{CuTi}_{2} \mathrm{O}_{9} |
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XRPD |
NPD |
XRPD |
NPD |
XRPD |
| P m \overline{3} m \rightarrow P b n m |
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| \mathrm{R}_{4}^{+} |
Imma (74) |
1 |
A1 |
1.22(3) |
1.20(1) |
1.25(4) |
1.26(1) |
1.40(4) |
| \mathrm{R}_{5}^{+} |
Imma (74) |
2 |
A2 |
0.04(3) |
0.03(1) |
0.06(4) |
0.04(1) |
-0.04(4) |
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A3 |
-0.08(1) |
-0.06(1) |
-0.09(1) |
-0.03(1) |
-0.12(1) |
| \mathrm{X}_{5}^{+} |
Cmcm (63) |
2 |
A4 |
0.21(2) |
0.24(1) |
0.22(3) |
0.21(1) |
0.36(3) |
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A5 |
0.50(1) |
0.52(1) |
0.51(1) |
0.44(1) |
0.61(1) |
| \mathrm{M}_{2}^{+} |
P4/mbm (127) |
1 |
A6 |
0.09(3) |
0.01(1) |
0.08(4) |
0.01(1) |
0.07(4) |
| \mathrm{M}_{3}^{+} |
P4/mbm (127) |
1 |
A7 |
0.94(3) |
1.03(1) |
0.95(4) |
0.96(1) |
1.09(4) |
| Direction: \mathrm{R}_{4}^{+}(0, a,-a), \mathrm{R}_{5}^{+}(0, a, a), \mathrm{X}_{5}^{+}(0,0, a, 0,0,0), \mathrm{M}_{2}^{+}(a, 0,0), \mathrm{M}_{3}^{+}(a, 0,0) |
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\mathrm{BaLa}_{2} \mathrm{CuTi}_{2} \mathrm{O}_{9} XRPD |
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\mathrm{BaPr}_{2} \mathrm{CuTi}_{2} \mathrm{O}_{9} XRPD |
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\mathrm{BaNd}_{2} \mathrm{CuTi}_{2} \mathrm{O}_{9} XRPD |
| P m \overline{3} m \rightarrow I 4 / m c m |
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| \mathbf{R}_{4}^{+} |
I4/mcm (140) |
1 |
A1 |
-0.27(6) |
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-0.37(8) |
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-0.35(9) |
| K -vector: \mathrm{R}_{4}^{+}(1 / 2,1 / 2,1 / 2); direction: \mathrm{R}_{4}^{+}(a, 0,0) |
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Evidence