Warning: Compilation failed: nothing to repeat at offset 0 in /srv/www/htdocs/icsd/dbconfig.php on line 84

Warning: Compilation failed: nothing to repeat at offset 0 in /srv/www/htdocs/icsd/dbconfig.php on line 85
ICSD for WWW : Details

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=72325 Help
TitleShort Te...Te bonding contacts in a new layered ternary telluride: synthesis and crystal structure of 2D Nb3GexTe6 (x=0.9).
AuthorsMonconduit, L.;Evain, M.;Boucher, F.;Brec, R.;Rouxel, J.
ReferenceZeitschrift fuer Anorganische und Allgemeine Chemie (1992) 616, 177-182
Link XRef SCOPUS SCIRUS Google
CompoundGe0.898 Nb3 Te6 - Niobium germanium telluride (3/0.9/6) [AB3X6] [oP40] [d3 c4] []
Cell6.4318(5), 13.9198(11), 11.5407(5), 90., 90., 90.
PNMA (62) V=1033.23
RemarksR=0.034000 : TEM =295 : DEF
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
Nb1(4c)2.803
Nb2(4c)2.803
Nb3(4c)2.803
Ge1(4c)4
Te1(8d)-2
Te2(8d)-2
Te3(8d)-2
0.3265(1)0.250.66686(6)01
0.0340(1)0.250.31357(6)01
0.3048(1)0.250.96742(6)01
0.4250(1)0.250.42499(9)00.898(3)
0.21042(6)0.11544(3)0.15822(3)01
0.13970(5)0.11892(3)0.50504(3)01
0.14629(6)0.11406(3)0.81881(3)01
Atom (site) Oxid. U11, U22, U33, U12, U13, U23
Nb1(4c)2.803
Nb2(4c)2.803
Nb3(4c)2.803
Ge1(4c)4
Te1(8d)-2
Te2(8d)-2
Te3(8d)-2
0.0104(3)0.0085(3)0.0078(3)0-.0005(2)0
0.0067(2)0.0070(3)0.0064(3)0-.0001(2)0
0.0077(2)0.0089(3)0.0069(3)0-.0004(2)0
0.0080(3)0.0122(4)0.0078(4)00.0001(3)0
0.0088(1)0.0084(1)0.0094(2)-.0001(1)0.0010(1)-.0002(1)
0.0098(1)0.0088(2)0.0104(2)-.0003(1)-.0019(1)0.0006(1)
0.0087(1)0.0095(2)0.0095(1)-.0007(1)0.0001(1)-.0009(1)

Current PHP version: 4.3.8 - Current MySQL version: 4.0.21
Demo database
(The Full database will be used, if you are licensed, after the first query is entered)

Copying or publishing either the ICSD data or software without written permission is illegal.
The ICSD database is copyright © 2015 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).