Crystallography Open Database

Information card for entry 1560469

Preview

Coordinates	1560469.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	praseodymium nickel germanium sulfide (3/0.5/1/7)
Chemical name	praseodymium nickel germanium sulfide (3/0.5/1/7)
Formula	Ge Ni0.5 Pr3 S7
Calculated formula	Ge Ni0.5 Pr3 S7
Title of publication	Quaternary rare-earth sulfides RE 3 M 0.5 GeS 7 (RE=La‒Nd, Sm; M=Co, Ni) and Y 3 Pd 0.5 SiS 7
Authors of publication	Iyer, Abishek K.; Yin, Wenlong; Lee, Emma J.; Lin, Xinsong; Mar, Arthur
Journal of publication	Journal of Solid State Chemistry
Year of publication	2017
Journal volume	250
Pages of publication	14 - 23
a	10.1303 ± 0.0004 Å
b	10.1303 ± 0.0004 Å
c	5.7752 ± 0.0002 Å
α	90°
β	90°
γ	120°
Cell volume	513.27 ± 0.03 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	173
Hermann-Mauguin space group symbol	P 63
Hall space group symbol	P 6c
Residual factor for all reflections	0.0209
Residual factor for significantly intense reflections	0.0195
Weighted residual factors for significantly intense reflections	0.0394
Weighted residual factors for all reflections included in the refinement	0.04
Goodness-of-fit parameter for all reflections included in the refinement	1.088
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
262064 (current)	2021-02-18	cif/ Adding structures of 1560469 via cif-deposit CGI script.	1560469.cif