Crystallography Open Database

Information card for entry 1548340

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Coordinates	1548340.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cl16 Cu16 O8
Calculated formula	Cl16 Cu16 O8
Title of publication	Oxyhalides: A new class of high-TC multiferroic materials
Authors of publication	Li Zhao; Maria Teresa Fernandez-Diaz; Liu Hao Tjeng; Alexander C. Komarek
Journal of publication	Science Advances
Year of publication	2016
Journal volume	2
Pages of publication	1600353
a	7.4477 Å
b	9.5989 Å
c	9.6888 Å
α	90°
β	90°
γ	90°
Cell volume	692.65 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	3
Space group number	70
Hermann-Mauguin space group symbol	F d d d :2
Hall space group symbol	-F 2uv 2vw
Residual factor for all reflections	0.0308
Residual factor for significantly intense reflections	0.0256
Weighted residual factors for significantly intense reflections	0.0689
Weighted residual factors for all reflections included in the refinement	0.072
Goodness-of-fit parameter for significantly intense reflections	2.53
Goodness-of-fit parameter for all reflections included in the refinement	2.39
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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