Crystallography Open Database

Information card for entry 4335287

Preview

Coordinates	4335287.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	neodymium zinc arsenide (6/1.7/6.8)
Chemical name	neodymium zinc arsenide (6/1.7/6.8)
Formula	As6.83 Nd6 Zn1.67
Calculated formula	As6.828 Nd6 Zn1.652
Title of publication	Homologous Series of Rare-Earth Zinc Arsenides REZn2-xAs2.n(REAs) (RE= La-Nd, Sm;n= 3, 4, 5, 6)
Authors of publication	Xinsong Lin; Arthur Mar
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	7261 - 7270
a	4.2283 ± 0.0014 Å
b	4.2283 ± 0.0014 Å
c	72.58 ± 0.02 Å
α	90°
β	90°
γ	120°
Cell volume	1123.8 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	3
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	0.1025
Residual factor for significantly intense reflections	0.0521
Weighted residual factors for significantly intense reflections	0.1313
Weighted residual factors for all reflections included in the refinement	0.1581
Goodness-of-fit parameter for all reflections included in the refinement	1.019
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
179455 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/52.	4335287.cif
101196	2014-02-10	cif/ Adding structures of 4335287 via cif-deposit CGI script.	4335287.cif