Crystallography Open Database

Information card for entry 9013944

Preview

Coordinates	9013944.cif
Original paper (by DOI)	HTML

Structure parameters

Mineral name	Herbertsmithite
Formula	Cl2 Cu3 H6 O6 Zn
Calculated formula	Cl2 Cu3 H6 O6 Zn
Title of publication	Herbertsmithite, Cu3Zn(OH)6Cl2, a new species and the definition of paratacamite Locality: Mina Los Tres Presidentes, Sierra Gorda, Chile
Authors of publication	Braithwaite, R. S. W.; Mereiter, K.; Paar, W. H.; Clark, A. M.
Journal of publication	Mineralogical Magazine
Year of publication	2004
Journal volume	68
Pages of publication	527 - 539
a	6.834 Å
b	6.834 Å
c	14.075 Å
α	90°
β	90°
γ	120°
Cell volume	569.284 Å³
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
292002 (current)	2024-05-23	Inserting missing Z values into entries of range 9	9013944.cif
176465	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 9.	9013944.cif
120115	2014-07-12	Adding DOIs to range 9 structures.	9013944.cif
85285	2013-05-05	cod/ (saulius@koala.ibt.lt) Removing outdated _amcsd_database_code data items from all series 9 CIFs.	9013944.cif
77586	2013-03-28	cod/cif/ (saulius@koala.ibt.lt) Merging mineral data updates (_chemical_name_mineral, _chemical_name_common, structural formulae) sent to me by T.D. in his e-mail. The merge was done by the command: for i in split/*.cif do ( B=$(basename $i); C=$(echo $B\|awk '{print "/home/saulius/struct/cod/cif/"substr($0,1,1)"/"substr($0,2,2)"/"substr($0,4,2)"/"$0}'); ( set -x; cif_merge --over \ _chemical_name_mineral,_chemical_name_structure_type,_chemical_name_common,_chemical_name_systematic,_chemical_formula_structural,_chemical_formula_sum \ $C $i ) \ \| cif_filter --add-cif-header $C \ \| sponge $C ) done in the working copy of the following repository: URL: svn+ssh://pitonas.ibt.lt/home/xray/svn-repositories/xyz-extraction/contributions Repository Root: svn+ssh://pitonas.ibt.lt/home/xray/svn-repositories/xyz-extraction Repository UUID: 9acf3947-1f02-0410-ae2a-984b57ad209b Revision: 2625 Node Kind: directory Schedule: normal Last Changed Author: saulius Last Changed Rev: 2625 Last Changed Date: 2013-03-28 15:13:00 +0200 (Thu, 28 Mar 2013)	9013944.cif
35913	2012-02-28	cif/9/ Reorganising range 9 into a prefix-directory tree. Range 9 is the last range to be reorganised.	9013944.cif
1214	2010-06-10	cif/9/ Adding new CIFs from the AMCSD-resynchronisation-2010.04.24/ data processing.	9013944.cif