Crystallography Open Database

Information card for entry 4310788

Preview

Coordinates	4310788.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	In K Se4 Sn
Calculated formula	In K Se4 Sn
Title of publication	Cooling of Melts: Kinetic Stabilization and Polymorphic Transitions in the KInSnSe4 System
Authors of publication	Seong-Ju Hwang; Ratnasabapathy G. Iyer; Pantelis N. Trikalitis; Andrew G. Ogden; Mercouri G. Kanatzidis
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	2237 - 2239
a	13.7849 ± 0.0011 Å
b	13.7849 ± 0.0011 Å
c	13.7849 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	2619.5 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	205
Hermann-Mauguin space group symbol	P a -3
Hall space group symbol	-P 2ac 2ab 3
Residual factor for all reflections	0.0724
Residual factor for significantly intense reflections	0.0641
Weighted residual factors for significantly intense reflections	0.1056
Weighted residual factors for all reflections included in the refinement	0.108
Goodness-of-fit parameter for all reflections included in the refinement	1.296
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
179146 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/07.	4310788.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4310788.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4310788.cif
2280	2010-11-10	../uploads/cif-deposit/cod/cif Adding structures of 4310788 via cif-deposit CGI script.	4310788.cif