Crystallography Open Database

Information card for entry 6000035

Preview

Coordinates	6000035.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cs2 O15 Si6 Ti
Calculated formula	Cs2 O15 Si6 Ti
Title of publication	Integrated experimental and computational methods for structure determination and characterization of a new, highly stable cesium silicotitanate phase, Cs~2~TiSi~6~O~15~ (SNL-A)
Authors of publication	Nyman, M.; Bonhomme, F.; Teter, D. M.; Maxwell, R. S.; Gu, B. X.; Wang, L. M.; Ewing, R. C.; Nenoff, T. M.
Journal of publication	Chemistry of Materials
Year of publication	2000
Journal volume	12
Pages of publication	3449 - 3458
a	12.998 ± 0.002 Å
b	7.5014 ± 0.0003 Å
c	15.156 ± 0.003 Å
α	90°
β	105.8 ± 0.03°
γ	90°
Cell volume	1420.8 ± 0.7 Å³
Number of distinct elements	4
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
277869 (current)	2022-09-15	cif/ Added space group information derived from the space group operation list using the 'cif_filter' program.	6000035.cif
176292	2016-02-09	cif/6/ (antanas@kurmis) Removing the _[local]_cod_text data item from multiple entries in range 6, since it held the same information as other data items in the entries (bibliography data items, for example). Also, bibliography was updated in several entries.	6000035.cif
103936	2014-03-10	cif/6/00/00/ Adding coordinates from original publication.	6000035.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	6000035.cif
966	2010-01-30	cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated.	6000035.cif
878	2009-11-19	cif/6/ Splitting the corrected 6.cif file, adding the splitted range 6 files: cif_split_primitive -o 6/ < 6.cif	6000035.cif