Crystallography Open Database

Information card for entry 9016209

Preview

Coordinates	9016209.cif
External links	AMCSD

Structure parameters

Mineral name	Donnayite-(Y)
Formula	C2 H2 Ba0.09 Ca0.19 Ce0.11 Dy0.02 Er0.01 Gd0.02 La0.09 Na0.5 O7 Pr0.01 Sr0.71 Y0.24 Yb0.01
Calculated formula	C2.00002 H2.00004 Ba0.09 Ca0.19 Ce0.11 Dy0.02 Er0.01 Gd0.02 La0.09 Na0.5 O7.00002 Pr0.01 Sr0.71 Y0.24 Yb0.01
Title of publication	Polymorphism of donnayite (Na,TR)Sr(CO3)2*H2O
Authors of publication	Tjy, C. T. L.; Pobedimskaya, E. A.; Nadezhina, T. N.; Khomyakov, A. P.
Journal of publication	Moscow University Geology Bulletin
Year of publication	1992
Journal volume	47
Pages of publication	60 - 70
a	5.211 Å
b	5.211 Å
c	18.357 Å
α	90°
β	90°
γ	120°
Cell volume	431.692 Å³
Number of distinct elements	15
Space group number	160
Hermann-Mauguin space group symbol	R 3 m :H
Hall space group symbol	R 3 -2"
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
294031 (current)	2024-08-07	Automatically deduplicating atom labels using the 'cif_fix_AMCSD_atom_labels' script from the branch of 'cod-tools' [1]. There are still 34 COD entries for which _atom_site_aniso_label values could not be fixed; these will be fixed manually in later commits. Ref.: [1] Working Copy Root Path: /home/saulius/src/cod-tools URL: svn://cod.ibt.lt/cif-tools/branches/experiment/saulius-AMCSD-fix-aniso-labels Relative URL: ^/branches/experiment/saulius-AMCSD-fix-aniso-labels Repository Root: svn://cod.ibt.lt/cif-tools Repository UUID: 04be6746-3802-0410-999d-98508da1e98c Revision: 10224 Node Kind: directory Schedule: normal Last Changed Author: saulius Last Changed Rev: 10224 Last Changed Date: 2024-08-07 14:09:31 +0300 (Wed, 07 Aug 2024) cod/ (saulius@tasmanijos-velnias)	9016209.cif
283911	2023-05-21	cif/9/ (saulius@starta) Committing those COD entries from the range 9 that, after automatic atom type and hydrogen count estimation using 'cod-tools' r9581, have their declared and calculated formulae identical for heavy atom counts after rounding to the common precision (with larger differences only allowed for hydrogen atom counts).	9016209.cif
201816	2017-10-06	cod/ Enhancement: marking COD entries that are known to be related to the AMCSD entries using the _cod_related_entry data loop.	9016209.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.	9016209.cif
86000	2013-05-09	cif/ (saulius@koala.ibt.lt) Adding new mineral structures from AMCSD.	9016209.cif