Crystallography Open Database

Information card for entry 4332942

Preview

Coordinates	4332942.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Er1.2 Fe4 Si9.9
Calculated formula	Er1.054 Fe4 Si9.896
Title of publication	Superstructure in RE2-xFe4Si14-y(RE = Y, Gd−Lu) Characterized by Diffraction, Electron Microscopy, and Mössbauer Spectroscopy
Authors of publication	Han, Mi-Kyung; Wu, Ya-Qiao; Kramer, Matthew; Vatovez, Benjamin; Grandjean, Fernande; Long, Gary J.; Miller, Gordon J.
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Journal issue	26
Pages of publication	10503 - 10519
a	3.939 ± 0.0006 Å
b	3.939 ± 0.0006 Å
c	15.276 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	205.26 ± 0.06 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	194
Hermann-Mauguin space group symbol	P 63/m m c
Hall space group symbol	-P 6c 2c
Residual factor for all reflections	0.0148
Residual factor for significantly intense reflections	0.0147
Weighted residual factors for significantly intense reflections	0.0313
Weighted residual factors for all reflections included in the refinement	0.0313
Goodness-of-fit parameter for all reflections included in the refinement	1.192
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4332942.cif
98657	2014-01-30	cif/ Adding structures of 4332942 via cif-deposit CGI script.	4332942.cif