Crystallography Open Database

Information card for entry 4123416

Preview

Coordinates	4123416.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Au Bi Pb2 S3 Te2
Calculated formula	Au Bi Pb2 S3 Te2
Title of publication	Two-Dimensional Mineral [Pb2BiS3][AuTe2]: High-Mobility Charge Carriers in Single-Atom-Thick Layers.
Authors of publication	Fang, Lei; Im, Jino; Stoumpos, Constantinos C.; Shi, Fengyuan; Dravid, Vinayak; Leroux, Maxime; Freeman, Arthur J.; Kwok, Wai-Kwong; Chung, Duck Young; Kanatzidis, Mercouri
Journal of publication	Journal of the American Chemical Society
Year of publication	2015
Journal volume	137
Journal issue	6
Pages of publication	2311 - 2317
a	12.3722 ± 0.0016 Å
b	4.0997 ± 0.0007 Å
c	9.3435 ± 0.0014 Å
α	90°
β	90°
γ	90°
Cell volume	473.92 ± 0.12 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	59
Hermann-Mauguin space group symbol	P m m n :2
Hall space group symbol	-P 2ab 2a
Residual factor for all reflections	0.0867
Residual factor for significantly intense reflections	0.0632
Weighted residual factors for significantly intense reflections	0.1465
Weighted residual factors for all reflections included in the refinement	0.1565
Goodness-of-fit parameter for all reflections included in the refinement	1.053
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
179036 (current)	2016-03-22	cif/4/12/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/12/34.	4123416.cif
132893	2015-03-04	cif/ Updating files of 4123416 Original log message: Adding full bibliography for 4123416.cif.	4123416.cif
131288	2015-02-07	cif/ Adding structures of 4123416 via cif-deposit CGI script.	4123416.cif