Crystallography Open Database

Information card for entry 1571167

Preview

Coordinates	1571167.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Neodymium(III) <i>ortho</i>-oxidotungstate(VI)
Formula	Nd0.67 O4 W
Calculated formula	Nd0.6667 O4 W
Title of publication	Crystal structure of defect scheelite-type Nd2/3[WO4]
Authors of publication	Knies, Benjamin; Hartenbach, Ingo
Journal of publication	IUCrData
Year of publication	2024
Journal volume	9
Journal issue	3
Pages of publication	x240175
a	5.3048 ± 0.0003 Å
b	5.3048 ± 0.0003 Å
c	11.4999 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	323.62 ± 0.04 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.0331
Residual factor for significantly intense reflections	0.0224
Weighted residual factors for significantly intense reflections	0.0476
Weighted residual factors for all reflections included in the refinement	0.0499
Goodness-of-fit parameter for all reflections included in the refinement	1.008
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
300370 (current)	2025-07-05	Updating bibliography information from the data sent by Robert McMeeking. cod/ (saulius@pterodaktilis)	1571167.cif
290377	2024-03-07	cif/ Adding structures of 1571167 via cif-deposit CGI script.	1571167.cif