Crystallography Open Database

Information card for entry 4001322

Preview

Coordinates	4001322.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ag10 Br3 Te4
Calculated formula	Ag9.988 Br3 Te4.026
Title of publication	Polymorphism, Structural Frustration, and Electrical Properties of the Mixed Conductor Ag10Te4Br3
Authors of publication	Lange, Stefan; Bawohl, Melanie; Wilmer, Dirk; Meyer, Hinrich-Wilhelm; Wiemhöfer, Hans-Dieter; Nilges, T.
Journal of publication	Chemistry of Materials
Year of publication	2007
Journal volume	19
Journal issue	6
Pages of publication	1401
a	7.984 ± 0.002 Å
b	7.984 ± 0.002 Å
c	7.688 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	424.41 ± 0.19 Å³
Cell temperature	410 K
Ambient diffraction temperature	410 K
Number of distinct elements	3
Space group number	191
Hermann-Mauguin space group symbol	P 6/m m m
Hall space group symbol	-P 6 2
Residual factor for all reflections	0.0707
Residual factor for significantly intense reflections	0.0308
Weighted residual factors for significantly intense reflections	0.0638
Weighted residual factors for all reflections included in the refinement	0.0709
Goodness-of-fit parameter for significantly intense reflections	1.7
Goodness-of-fit parameter for all reflections included in the refinement	1.19
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
178377 (current)	2016-03-21	cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00.	4001322.cif
120073	2014-07-11	Adding DOIs to range 4/00 structures.	4001322.cif
45181	2012-03-20	../uploads/cif-deposit/cod/cif Adding structures of 4001322, 4001323, 4001324, 4001325 via cif-deposit CGI script.	4001322.cif