Crystallography Open Database

Information card for entry 7032212

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Coordinates	7032212.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	apatite
Chemical name	ellestadite
Formula	Ca10 Cl2 O24 P6
Calculated formula	Ca10 Cl2 O24 P6
Title of publication	Crystal chemical characteristics of ellestadite-type apatite: implications for toxic metal immobilization.
Authors of publication	Fang, Y. N.; Ritter, Clemens; White, T. J.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	42
Pages of publication	16031 - 16043
a	9.61822 ± 0.00016 Å
b	9.61822 ± 0.00016 Å
c	6.79199 ± 0.00015 Å
α	90°
β	90°
γ	120°
Cell volume	544.148 ± 0.018 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	4
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor R(I) for significantly intense reflections	0.029
Goodness-of-fit parameter for all reflections	0.69
Method of determination	powder diffraction
Diffraction radiation wavelength	1.38994 Å
Diffraction radiation type	neutron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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