Crystallography Open Database

Information card for entry 2312111

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Structure parameters

Formula	Nd0.51 Ni4.83 Tb1.51 Zn12.17
Calculated formula	Nd0.4956 Ni4.8265 Tb1.5044 Zn12.1735
Title of publication	Tb<sub>2-x</sub>Nd<sub>x</sub>Zn<sub>17-y</sub>Ni<sub>y</sub> (x = 0.5, y = 4.83): a new intermetallic with a maximum disordered structure and its hydrogen storage properties.
Authors of publication	Nytka, Vitalii; Kordan, Vasyl; Stetskiv, Andrij; Pavlyuk, Volodymyr
Journal of publication	Acta crystallographica. Section C, Structural chemistry
Year of publication	2023
Journal volume	79
Journal issue	Pt 6
Pages of publication	257 - 262
a	9.0637 ± 0.0005 Å
b	9.0637 ± 0.0005 Å
c	13.2319 ± 0.001 Å
α	90°
β	90°
γ	120°
Cell volume	941.38 ± 0.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	166
Hermann-Mauguin space group symbol	R -3 m :H
Hall space group symbol	-R 3 2"
Residual factor for all reflections	0.0861
Residual factor for significantly intense reflections	0.046
Weighted residual factors for significantly intense reflections	0.0866
Weighted residual factors for all reflections included in the refinement	0.096
Goodness-of-fit parameter for all reflections included in the refinement	0.9
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
285045 (current)	2023-07-06	cif/ Updating files of 2312111 Original log message: Adding full bibliography for 2312111.cif.	2312111.cif 2312111.hkl
283996	2023-05-25	cif/ hkl/ Adding structures of 2312111 via cif-deposit CGI script.	2312111.cif 2312111.hkl