Crystallography Open Database

Information card for entry 4001252

Preview

Coordinates	4001252.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ba2 In5 P5
Calculated formula	Ba2 In5 P5
Title of publication	Flux Growth and Electronic Properties of Ba2In5Pn5(Pn = P, As): Zintl Phases Exhibiting Metallic Behavior
Authors of publication	Mathieu, Josiah; Achey, Randall; Park, Ju-Hyun; Purcell, Kenneth M.; Tozer, Stanley W.; Latturner, Susan E.
Journal of publication	Chemistry of Materials
Year of publication	2008
Journal volume	20
Journal issue	17
Pages of publication	5675
a	17.257 ± 0.003 Å
b	4.1599 ± 0.0006 Å
c	17.49 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	1255.6 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0464
Residual factor for significantly intense reflections	0.0376
Weighted residual factors for significantly intense reflections	0.069
Weighted residual factors for all reflections included in the refinement	0.0718
Goodness-of-fit parameter for all reflections included in the refinement	1.196
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.	4001252.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4001252.cif
41942	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4001252, 4001253 via cif-deposit CGI script.	4001252.cif