Crystallography Open Database

Information card for entry 2100426

Preview

Coordinates	2100426.cif
Original IUCr paper	HTML

Structure parameters

Formula	Ba1.117 Ni0.117 O3 Rh0.883
Calculated formula	Ba24 Ni O6 Rh
Title of publication	Description of Ba~1+<i>x~</i>Ni~<i>x~</i>Rh~1{-~<i>x</i>}O~3~ with <i>x</i> = 0.1170(5) in superspace: modulated composite <i>versus</i> modulated-layer structure
Authors of publication	Schönleber, Andreas; Zúñiga, F. Javier; Perez-Mato, J. Manuel; Darriet, Jacques; zur Loye, Hans-Conrad
Journal of publication	Acta Crystallographica Section B
Year of publication	2006
Journal volume	62
Journal issue	2
Pages of publication	197 - 204
a	10.0576 ± 0.0008 Å
b	10.0576 ± 0.0008 Å
c	2.5862 ± 0.0008 Å
α	90°
β	90°
γ	120°
Cell volume	226.56 ± 0.07 Å³
Ambient diffraction temperature	293 K
Number of distinct elements	4
Hermann-Mauguin space group symbol	R-3m(00\g)0s
Residual factor for all reflections	0.0379
Residual factor for significantly intense reflections	0.0379
Weighted residual factors for significantly intense reflections	0.0481
Weighted residual factors for all reflections included in the refinement	0.0481
Goodness-of-fit parameter for all reflections included in the refinement	1.26
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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