Crystallography Open Database

Information card for entry 1562187

Preview

Coordinates	1562187.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Potassium Titanium Nickel Oxide
Chemical name	Potassium Titanium Nickel Oxide
Formula	K1.55 Ni0.78 O16 Ti7.22
Calculated formula	K1.552 Ni0.776 O16 Ti7.224
Title of publication	Synthesis and crystal chemistry of microporous titanates K (Ti,M)8O16 where M=Sc‒Ni
Authors of publication	Moetakef, Pouya; Larson, Amber M.; Hodges, Brenna C.; Zavalij, Peter; Gaskell, Karen J.; Piccoli, Philip M.; Rodriguez, Efrain E.
Journal of publication	Journal of Solid State Chemistry
Year of publication	2014
Journal volume	220
Pages of publication	45 - 53
a	10.192 ± 0.004 Å
b	10.192 ± 0.004 Å
c	2.9764 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	309.2 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	87
Hermann-Mauguin space group symbol	I 4/m
Hall space group symbol	-I 4
Residual factor for all reflections	0.0211
Residual factor for significantly intense reflections	0.0175
Weighted residual factors for significantly intense reflections	0.0395
Weighted residual factors for all reflections included in the refinement	0.0405
Goodness-of-fit parameter for all reflections included in the refinement	1
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
264623 (current)	2021-04-28	cif/ Adding structures of 1562187, 1562188, 1562189, 1562190, 1562191 via cif-deposit CGI script.	1562187.cif