Crystallography Open Database

Information card for entry 7059626

Preview

Coordinates	7059626.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	F63 K18 Ta5.18 Zr4.82
Calculated formula	F63 K18 Ta5.18 Zr4.82
Title of publication	The structure of the metastable K18Ta5Zr5F63 phase
Authors of publication	Boča, Miroslav; Molokeev, Maxim; Rakhmatullin, Aydar; Kubíková, Blanka; Netriová, Zuzana
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	22
Pages of publication	9264 - 9270
a	17.3782 ± 0.0008 Å
b	17.3782 ± 0.0008 Å
c	5.8377 ± 0.0003 Å
α	90°
β	90°
γ	120°
Cell volume	1526.8 ± 0.13 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 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 for all reflections	0.0873
Residual factor for significantly intense reflections	0.0855
Weighted residual factors for significantly intense reflections	0.2241
Weighted residual factors for all reflections included in the refinement	0.2251
Goodness-of-fit parameter for all reflections included in the refinement	1.223
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7059626.html