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=100217 Help
TitleKristallchemische Untersuchung der Mischungsreihe Ni3 Pb2 S2 - Ni3 Pb2 Se2 sowie eine Bemerkung zur Shandit-Struktur.
AuthorsClauss, A.;Warasteh, M.;Weber, K.
ReferenceNeues Jahrbuch fuer Mineralogie. Monatshefte (1978) 1978, 256-268
Link XRef SCOPUS SCIRUS Google
Also: Journal of the Less-Common Metals (1976) 45, 185-191
Link XRef SCOPUS SCIRUS Google
CompoundNi3 S2 Sn2 - Nickel tin sulfide (3/2/2) [A2N3X2] [hR7] [e c b a] []
Cell5.404, 5.404, 5.404, 60.68, 60.68, 60.68
R3-MR (166) V=113.3
RemarksCOR PDF =48-1775 :
No R value given in the paper.
At least one temperature factor missing in the paper.
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.
Hexagonal setting: 5.461, 13.188, cp. 402458
PDF 48-1775, 86-1553
Cell of Ni3 Pb2 S2: 5.568, 60.26
Cell of Ni3 Pb2 Se2: 5.767, 58.34
Cell of Ni3 In2 S2: 5.484, 58.62
Cell of Ni3 Tl2 S2: 5.594, 58.53
Revised data of 453 in B112/m, R was 0.04

Atom (site) Oxid. x, y, z, B, Occupancy
Ni1(3e)0
Sn1(1a)2
Sn2(1b)2
S1(2c)-2
00.50.501
00001
0.50.50.501
0.2150.2150.21501

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).