Crystallography Open Database

Information card for entry 1560472

Preview

Coordinates	1560472.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	yttrium palladium silicon sulfide (3/0.5/1/7)
Chemical name	yttrium palladium silicon sulfide (3/0.5/1/7)
Formula	Pd0.5 S7 Si Y3
Calculated formula	Pd0.5 S7 Si Y3
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	9.7891 ± 0.0003 Å
b	9.7891 ± 0.0003 Å
c	5.684 ± 0.0004 Å
α	90°
β	90°
γ	120°
Cell volume	471.7 ± 0.04 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	0.0542
Residual factor for significantly intense reflections	0.0413
Weighted residual factors for significantly intense reflections	0.102
Weighted residual factors for all reflections included in the refinement	0.1084
Goodness-of-fit parameter for all reflections included in the refinement	1.117
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
262067 (current)	2021-02-18	cif/ Adding structures of 1560472 via cif-deposit CGI script.	1560472.cif