Crystallography Open Database

Information card for entry 7036313

Preview

Coordinates	7036313.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Cesium Sodium Thallium Germanium
Formula	Cs4 Ge68 Na4.18 Tl3.82
Calculated formula	Cs4 Ge68 Na4.176 Tl3.824
Title of publication	Structure and properties of type-II clathrate Cs8Na16-xTlxGe136.
Authors of publication	Zhang, Hui; Li, Wei; Xu, Xuguang; Mu, Gang; Xie, Xiaoming; Huang, Fuqiang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	38
Pages of publication	16937 - 16945
a	15.4863 ± 0.00005 Å
b	15.4863 ± 0.00005 Å
c	15.4863 ± 0.00005 Å
α	90°
β	90°
γ	90°
Cell volume	3714.01 ± 0.02 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 K
Number of distinct elements	4
Space group number	227
Hermann-Mauguin space group symbol	F d -3 m :2
Hall space group symbol	-F 4vw 2vw 3
Residual factor for all reflections	0.0414
Residual factor R(I) for significantly intense reflections	0.0684
Goodness-of-fit parameter for all reflections	0.25608
Method of determination	powder diffraction
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54056 Å
Diffraction radiation type	CuKα~1~
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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