ICSD for WWW

Details of the selected entries


1 entry selected.
CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
***Click the ANX, Pearson or Wyckoff Symbol to find structures with that symbol***.
CC=83859 Help
TitleTa(5+) displacements in Cs Ta Q3 (Q = S, Se, and Te): new one-dimensional materials with the Ba V S3 structure.
AuthorsPell, M.A.;Vajenine, G.V.M.;Ibers, J.A.
ReferenceIC&volume=119&fpage=518&details=yes target=icsd_help>Journal of the American Chemical Society (1997) 119, 518-519
Link XRef SCOPUS Google
CompoundCs1 Ta1 Te3 - Caesium tritellurotantalate [ABX3] [hP10] [h e d] []
Cell7.992(4), 7.992(4), 6.496(4), 90., 90., 120.
P63/MMC (194) V=359.33
RemarksR=0.038000 : T =115 : D
The coordinates are those given in the paper but the atomic distances do not agree with those calculated during testing.The coordinates are probably correct.

Atom (site) Oxid. x, y, z, B, Occupancy
Cs1(2d)1
Ta1(4e)5
Te1(6h)-2
0.330.660.750.021
000.050.020.5
0.160.320.250.021

Demo database


Copying or publishing either the ICSD data or software without written permission is illegal.
The ICSD database is copyright © 2018 by Fachinformationszentrum (FIZ) Karlsruhe
The PHP-mySQL WWW interface is copyright © 2003-2015 by Peter Hewat
The 3D crystal structure visualisation software, xtal-3d is copyright © 1994-2015 by Marcus Hewat
The PHP-JMOL drawing software is copyright © 2006-2015 by Alan Hewat
Please report technical problems with ICSD for WWW to alan.hewat[a]neutronoptics.com (Alan Hewat).