Crystallography Open Database

Information card for entry 4305342

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Coordinates	4305342.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cu21.5 Ga66 Li14.73 Mg36.77
Calculated formula	Cu21.55 Ga66 Li14.8 Mg36.65
Title of publication	Li14.7Mg36.8Cu21.5Ga66: An Intermetallic Representative of a Type IV Clathrate
Authors of publication	Qisheng Lin; John D. Corbett
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	10825 - 10831
a	14.0803 ± 0.0004 Å
b	14.0803 ± 0.0004 Å
c	13.6252 ± 0.0008 Å
α	90°
β	90°
γ	120°
Cell volume	2339.36 ± 0.17 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	4
Space group number	187
Hermann-Mauguin space group symbol	P -6 m 2
Hall space group symbol	P -6 2
Residual factor for all reflections	0.0727
Residual factor for significantly intense reflections	0.0648
Weighted residual factors for significantly intense reflections	0.1767
Weighted residual factors for all reflections included in the refinement	0.1864
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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