Crystallography Open Database

Information card for entry 4002657

Preview

Coordinates	4002657.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Al1.76 Na1.76 Sn4.24
Calculated formula	Al1.758 Na1.758 Sn4.242
Title of publication	Synthesis, Crystal Structure, and Thermoelectric Properties of Na2+xAl2+xSn4‒x(x= −0.38, ‒0.24)
Authors of publication	Kanno, Masahiro; Yamada, Takahiro; Yamane, Hisanori; Nagai, Hideaki
Journal of publication	Chemistry of Materials
Year of publication	2016
Journal volume	28
Journal issue	2
Pages of publication	601
a	6.3984 ± 0.0003 Å
b	6.3984 ± 0.0003 Å
c	6.1529 ± 0.0003 Å
α	90°
β	90°
γ	120°
Cell volume	218.149 ± 0.018 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	178
Hermann-Mauguin space group symbol	P 61 2 2
Hall space group symbol	P 61 2 (0 0 5)
Residual factor for all reflections	0.0134
Residual factor for significantly intense reflections	0.0126
Weighted residual factors for significantly intense reflections	0.0263
Weighted residual factors for all reflections included in the refinement	0.0266
Goodness-of-fit parameter for all reflections included in the refinement	1.119
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
208253 (current)	2018-06-10	cif/ Updating space group information in entries 1540551, 4002656, 4002657.	4002657.cif
175775	2016-02-04	cif/ Updating files of 4002656, 4002657 Original log message: Adding full bibliography for 4002656--4002657.cif.	4002657.cif
174423	2016-01-14	cif/ Adding structures of 4002657 via cif-deposit CGI script.	4002657.cif