Crystallography Open Database

Information card for entry 2310781

Preview

Coordinates	2310781.cif
Original IUCr paper	HTML

Structure parameters

Formula	Bi0.195 Fe1.046 O2.633 Pb0.763
Calculated formula	Bi0.1948 Fe1.04646 O2.63256 Pb0.76282
Title of publication	Synergy between transmission electron microscopy and powder diffraction: application to modulated structures.
Authors of publication	Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke
Journal of publication	Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials
Year of publication	2015
Journal volume	71
Journal issue	2
Pages of publication	127 - 143
a	3.92822 ± 0.00013 Å
b	3.92661 ± 0.0001 Å
c	4.05202 ± 0.00014 Å
α	90°
β	92.209 ± 0.003°
γ	90°
Cell volume	62.454 ± 0.003 Å³
Cell temperature	900 K
Ambient diffraction temperature	900 K
Number of distinct elements	4
Space group number	12
Hermann-Mauguin space group symbol	I 1 2/m 1
Hall space group symbol	-I 2y
Residual factor for all reflections	0.0406
Residual factor for significantly intense reflections	0.04
Weighted residual factors for all reflections	0.0555
Weighted residual factors for significantly intense reflections	0.0554
Goodness-of-fit parameter for all reflections	2.38
Method of determination	powder diffraction
Diffraction radiation probe	neutron
Diffraction radiation wavelength	1.8857 Å
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
209177 (current)	2018-07-21	cif/ Updating space group information in entries 1534361, 1536345, 1536349, 1536353, 1536800, 1537570, 2020150, 2020151, 2107011, 2107129, 2107130, 2107227, 2107229, 2310780, 2310781, 2310782, 2310783, 2310784, 2310849, 4002590, 4344308.	2310781.cif
201367	2017-09-27	cif/2/31/07/ Updating bibliography in entries 2310780-2310784.	2310781.cif
160956	2015-10-08	cif/ Adding structures of 2310781 via cif-deposit CGI script.	2310781.cif