Crystallography Open Database

Information card for entry 1512500

Preview

Coordinates	1512500.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cl
Calculated formula	Cl
SMILES	ClCl
Title of publication	Error Estimates for Solid-State Density-Functional Theory Predictions: An Overview by Means of the Ground-State Elemental Crystals
Authors of publication	Lejaeghere, K.; Van Speybroeck, V.; Van Oost, G.; Cottenier, S.
Journal of publication	Critical Reviews in Solid State and Materials Sciences
Year of publication	2014
Journal volume	39
Journal issue	1
Pages of publication	1
a	7.77875 Å
b	4.34941 Å
c	9.02754 Å
α	90°
β	90°
γ	90°
Cell volume	305.429 Å³
Number of distinct elements	1
Space group number	64
Hermann-Mauguin space group symbol	C m c a
Hall space group symbol	-C 2ac 2
Method of determination	theoretical
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/1512500.html