Crystallography Open Database

Information card for entry 4329325

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Coordinates	4329325.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ni O
Calculated formula	Ni O
Title of publication	Substitutional Mechanism of Ni into the Wide-Band-Gap Semiconductor InTaO4 and Its Implications for Water Splitting Activity in the Wolframite Structure Type
Authors of publication	Andrew C. Malingowski; Peter W. Stephens; Ashfia Huq; Qingzhen Huang; Syed Khalid; Peter G. Khalifah
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	6096 - 6103
a	4.1771 ± 0.00008 Å
b	4.1771 Å
c	4.1771 Å
α	90°
β	90°
γ	90°
Cell volume	72.8827 ± 0.0014 Å³
Number of distinct elements	2
Space group number	225
Hermann-Mauguin space group symbol	F m -3 m
Hall space group symbol	-F 4 2 3
RFsqd	0.08053
Goodness-of-fit parameter for all reflections	0.99
Method of determination	powder diffraction
Diffraction radiation probe	neutron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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