Crystallography Open Database

Information card for entry 2021616

2021615 << 2021616 >> 2021617

Preview

Structure parameters

Chemical name	Barium Calcium Carbonate
Formula	C2 Ba Ca O6
Calculated formula	C2 Ba Ca O6
Title of publication	A new BaCa(CO3)2 polymorph
Authors of publication	Spahr, Dominik; Bayarjargal, Lkhamsuren; Vinograd, Victor; Luchitskaia, Rita; Milman, Victor; Winkler, Björn
Journal of publication	Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials
Year of publication	2019
Journal volume	75
Journal issue	3
a	6.6775 ± 0.0005 Å
b	5.0982 ± 0.0004 Å
c	4.19239 ± 0.00029 Å
α	90°
β	109.259 ± 0.0013°
γ	90°
Cell volume	134.736 ± 0.017 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
RFsqd	0.13286
Method of determination	powder diffraction
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54056 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2021616.html