Crystallography Open Database

Information card for entry 7031395

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Coordinates	7031395.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ba I6 O18 Zr
Calculated formula	Ba I6 O18 Zr
Title of publication	Dimensionality variations in new zirconium iodates: hydrothermal syntheses, structural determination, and characterization of BaZr(IO3)6 and K2Zr(IO3)6.
Authors of publication	Ahn, Hyun Sun; Lee, Dong Woo; Ok, Kang Min
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	27
Pages of publication	10456 - 10461
a	7.7497 ± 0.0003 Å
b	7.7663 ± 0.0003 Å
c	14.7514 ± 0.0006 Å
α	91.129 ± 0.003°
β	102.966 ± 0.003°
γ	90.85 ± 0.003°
Cell volume	864.86 ± 0.06 Å³
Cell temperature	298 ± 0.2 K
Ambient diffraction temperature	298 ± 0.2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0907
Residual factor for significantly intense reflections	0.0421
Weighted residual factors for significantly intense reflections	0.0473
Weighted residual factors for all reflections included in the refinement	0.0617
Goodness-of-fit parameter for all reflections included in the refinement	0.838
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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