Crystallography Open Database

Information card for entry 7127495

Preview

Coordinates	7127495.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cl Er23 Mn7 Rb6 Se44
Calculated formula	Cl Er23 Mn6.99996 Rb6 Se44
Title of publication	A new type of novel salt-inclusion chalcogenide with ultralow thermal conductivity.
Authors of publication	Chen, Hong; Liu, Peng-Fei; Lin, Hua; Wu, Xin-Tao
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	96
Pages of publication	15149 - 15152
a	19.948 ± 0.0006 Å
b	19.948 ± 0.0006 Å
c	19.5948 ± 0.0011 Å
α	90°
β	90°
γ	120°
Cell volume	6752.6 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	166
Hermann-Mauguin space group symbol	R -3 m :H
Hall space group symbol	-R 3 2"
Residual factor for all reflections	0.0315
Residual factor for significantly intense reflections	0.0291
Weighted residual factors for significantly intense reflections	0.0747
Weighted residual factors for all reflections included in the refinement	0.0766
Goodness-of-fit parameter for all reflections included in the refinement	1.067
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7127495.html